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

Systemtic Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxidanylidene-ethyl]-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-3-cyclohexyl-1-[2-[4-(dimethylamino)-1-piperidyl]-2-oxo-ethyl]indole-6-carboxylic acid CAS Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)-1-piperidinyl]-2-oxoethyl]-2-(4-phenylmethoxyphenyl)-6-indolecarboxylic acid IUPAC Name: 3-cyclohexyl-1-[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-2-(4-phenylmethoxyphenyl)indole-6-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-3-cyclohexyl-1-[2-[4-(dimethylamino)piperidino]-2-keto-ethyl]indole-6-carboxylic acid Formula: C37H43N3O4 MolecularWeight: 593.75502

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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=C(C=C4)OCC5=CC=CC=C5)C6CCCCC6

Isomeric SMILES

CN(C)C1CCN(CC1)C(=O)CN2C3=C(C=CC(=C3)C(=O)O)C(=C2C4=CC=C(C=C4)OCC5=CC=CC=C5)C6CCCCC6

InChI

InChI=1S/C37H43N3O4/c1-38(2)30-19-21-39(22-20-30)34(41)24-40-33-23-29(37(42)43)15-18-32(33)35(27-11-7-4-8-12-27)36(40)28-13-16-31(17-14-28)44-25-26-9-5-3-6-10-26/h3,5-6,9-10,13-18,23,27,30H,4,7-8,11-12,19-22,24-25H2,1-2H3,(H,42,43)