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 7 results

Search term: GTYMTYBCXVOBBB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
142955

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3
C16H23NO3277.3587416100
112716

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3/t10-,13+/m1/s1
C16H23NO3277.358710900
28651704

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3/t10?,13-/m1/s1
C16H23NO3277.35874200
28652012

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3/t10?,13-/m0/s1
C16H23NO3277.35872200
23191004

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3/t10-,13-/m1/s1
C16H23NO3277.35872200
23191005

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3/t10-,13+/m0/s1
C16H23NO3277.35872200
23191006

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H23NO3/c1-10(18)12-7-5-6-11-8-14(20-15(11)12)13(19)9-17-16(2,3)4/h5-8,10,13,17-19H,9H2,1-4H3/t10-,13-/m0/s1
C16H23NO3277.35872200

Advertisement