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: GWHXMUJKGXTFTL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3017723

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3
C18H21N251.3660410600
5401789

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/t14-,18+/m0/s1
C18H21N251.3662100
5401791

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/t14-,18-/m1/s1
C18H21N251.3662100
5401793

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/t14-,18-/m0/s1
C18H21N251.3662100
5401795

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/t14-,18+/m1/s1
C18H21N251.3662100
5401794

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/p+1/t14-,18+/m1/s1
C18H22N252.37341100
5401792

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/p+1/t14-,18-/m0/s1
C18H22N252.37341100
5401790

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/p+1/t14-,18-/m1/s1
C18H22N252.37341100
5401788

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H21N/c1-14-13-16-9-5-6-10-17(16)18(19-14)12-11-15-7-3-2-4-8-15/h2-10,14,18-19H,11-13H2,1H3/p+1/t14-,18+/m0/s1
C18H22N252.37341100

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