methyl (1S,2R)-2-(1-methylindol-3-yl)carbonylcyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2R)-2-(1-methylindol-3-yl)carbonylcyclohexane-1-carboxylate Openeye Name: methyl (1S,2R)-2-(1-methylindole-3-carbonyl)cyclohexanecarboxylate CAS Name: (1S,2R)-2-[(1-methyl-3-indolyl)-oxomethyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R)-2-(1-methylindole-3-carbonyl)cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-(1-methylindole-3-carbonyl)cyclohexanecarboxylic acid methyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)C3CCCCC3C(=O)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)[C@@H]3CCCC[C@@H]3C(=O)OC

InChI

InChI=1S/C18H21NO3/c1-19-11-15(12-7-5-6-10-16(12)19)17(20)13-8-3-4-9-14(13)18(21)22-2/h5-7,10-11,13-14H,3-4,8-9H2,1-2H3/t13-,14+/m1/s1