3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-indole-6-carboxylic acid

Systemtic Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-phenyl-indole-6-carboxylic acid Openeye Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)-1-piperidyl]-2-oxo-ethyl]-2-phenyl-indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)-1-piperidinyl]-2-oxoethyl]-2-phenyl-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-2-phenylindole-6-carboxylic acid Traditional Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidino]-2-keto-ethyl]-2-phenyl-indole-6-carboxylic acid Formula: C30H37N3O3 MolecularWeight: 487.63308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CN(C)C1CCN(CC1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C30H37N3O3/c1-31(2)24-15-17-32(18-16-24)27(34)20-33-26-19-23(30(35)36)13-14-25(26)28(21-9-5-3-6-10-21)29(33)22-11-7-4-8-12-22/h4,7-8,11-14,19,21,24H,3,5-6,9-10,15-18,20H2,1-2H3,(H,35,36)