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: NTISAKGPIGTIJJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5374095

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9-/m0/s1
C11H22N2O3S262.369313000
105706

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)
C11H22N2O3S262.369192101
50660703

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9+/m0/s1
C11H22N2O3S262.3693300
50651387

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9+/m1/s1
C11H22N2O3S262.3692200
50660658

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8?,9-/m1/s1
C11H22N2O3S262.3691100
50651364

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9?/m1/s1
C11H22N2O3S262.3691100
71196445

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9?/m0/s1
C11H22N2O3S262.3691100
72114535

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9-/m1/s1
C11H22N2O3S262.3691200
115068808

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8?,9-/m0/s1
C11H22N2O3S262.3691100

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