ethyl 1-[3-(3-phenoxyphenyl)-3-[1-(phenylmethyl)indol-3-yl]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(3-phenoxyphenyl)-3-[1-(phenylmethyl)indol-3-yl]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(1-benzylindol-3-yl)-3-(3-phenoxyphenyl)propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-(3-phenoxyphenyl)-3-[1-(phenylmethyl)-3-indolyl]propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1-benzylindol-3-yl)-3-(3-phenoxyphenyl)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(1-benzylindol-3-yl)-3-(3-phenoxyphenyl)propanoyl]isonipecotic acid ethyl ester Formula: C38H38N2O4 MolecularWeight: 586.71932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CC(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C38H38N2O4/c1-2-43-38(42)29-20-22-39(23-21-29)37(41)25-34(30-14-11-17-32(24-30)44-31-15-7-4-8-16-31)35-27-40(26-28-12-5-3-6-13-28)36-19-10-9-18-33(35)36/h3-19,24,27,29,34H,2,20-23,25-26H2,1H3