Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 21 results

Search term: MRMBZHPJVKCOMA (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
64442

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8-,10-,11-/m1/s1
C15H18N4O4S350.392894861931
64443

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/p+1/t7-,8-,10-,11-/m1/s1
C15H19N4O4S351.40028700
3685878

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3
C15H18N4O4S350.3928257900
24021570

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8?,10-,11-/m1/s1
C15H18N4O4S350.39284100
62397387

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8-,10-,11+/m1/s1
C15H18N4O4S350.39283300
30809723

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8+,10+,11+/m0/s1
C15H18N4O4S350.39282400
8793352

Charge

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/p+1/t7-,8-,10-,11-/m1/s1/i5D,6D
C15H17D2N4O4S353.41252200
21537485

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8+,10+,11+/m1/s1
C15H18N4O4S350.39282100
3685879

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/p+1
C15H19N4O4S351.400762100
7974256

Charge

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/p+1/t7-,8-,10?,11?/m1/s1
C15H19N4O4S351.40022100
7995541

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8-,10?,11-/m1/s1
C15H18N4O4S350.39282100
7995542

Charge

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/p+1/t7-,8-,10?,11-/m1/s1
C15H19N4O4S351.40022100
8793351

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8-,10-,11-/m1/s1/i5D,6D
C15H16D2N4O4S352.40511200
82962942

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8?,10-,11?/m1/s1
C15H18N4O4S350.39281100
82963331

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7?,8-,10-,11-/m1/s1
C15H18N4O4S350.39281100
114391750

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C15H18N4O4S/c1-7-11-10(8(2)20)14(21)19(11)12(15(22)23)13(7)24-9-3-17-5-16-6-18(17)4-9/h5-11,20H,3-4H2,1-2H3/t7-,8-,10+,11+/m1/s1
C15H18N4O4S350.39281100
12

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