methyl 3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-(3-methanoylphenyl)indole-6-carboxylate

Systemtic Name: methyl 3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-(3-methanoylphenyl)indole-6-carboxylate Openeye Name: methyl 3-cyclohexyl-1-[2-(dimethylamino)-2-oxo-ethyl]-2-(3-formylphenyl)indole-6-carboxylate CAS Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(3-formylphenyl)-6-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(3-formylphenyl)indole-6-carboxylate Traditional Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-keto-ethyl]-2-(3-formylphenyl)indole-6-carboxylic acid methyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)OC)C(=C1C3=CC(=CC=C3)C=O)C4CCCCC4

Isomeric SMILES

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)OC)C(=C1C3=CC(=CC=C3)C=O)C4CCCCC4

InChI

InChI=1S/C27H30N2O4/c1-28(2)24(31)16-29-23-15-21(27(32)33-3)12-13-22(23)25(19-9-5-4-6-10-19)26(29)20-11-7-8-18(14-20)17-30/h7-8,11-15,17,19H,4-6,9-10,16H2,1-3H3