3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-naphthalen-2-yl-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxidanylidene-ethyl]-2-naphthalen-2-yl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxo-ethyl]-2-(2-naphthyl)indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-(2-naphthalenyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-naphthalen-2-ylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-(dimethylamino)-2-keto-ethyl]-2-(2-naphthyl)indole-6-carboxylic acid Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CC4=CC=CC=C4C=C3)C5CCCCC5

Isomeric SMILES

CN(C)C(=O)CN1C2=C(C=CC(=C2)C(=O)O)C(=C1C3=CC4=CC=CC=C4C=C3)C5CCCCC5

InChI

InChI=1S/C29H30N2O3/c1-30(2)26(32)18-31-25-17-23(29(33)34)14-15-24(25)27(20-9-4-3-5-10-20)28(31)22-13-12-19-8-6-7-11-21(19)16-22/h6-8,11-17,20H,3-5,9-10,18H2,1-2H3,(H,33,34)