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 9 results

Search term: SLWWJZMPHJJOPH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
388830

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6-/m1/s1
C7H8O5172.1354444700
79

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)
C7H8O5172.13542124700
4573915

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/p-1/t5-,6-/m1/s1
C7H7O5171.1286500
21232119

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6-/m0/s1
C7H8O5172.13543200
8877708

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6-/m1/s1/i1D,6D
C7H6D2O5174.14772200
61320071

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6+/m0/s1
C7H8O5172.13542300
111311991

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6+/m1/s1
C7H8O5172.13541100
24785422

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/p-1
C7H7O5171.1281200

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