ethyl 1-[3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(1-ethylindol-3-yl)-3-(p-tolyl)propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-(1-ethyl-3-indolyl)-3-(4-methylphenyl)-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1-ethylindol-3-yl)-3-(4-methylphenyl)propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-(1-ethylindol-3-yl)-3-(p-tolyl)propanoyl]nipecotic acid ethyl ester Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCCC(C3)C(=O)OCC)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCCC(C3)C(=O)OCC)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H34N2O3/c1-4-29-19-25(23-10-6-7-11-26(23)29)24(21-14-12-20(3)13-15-21)17-27(31)30-16-8-9-22(18-30)28(32)33-5-2/h6-7,10-15,19,22,24H,4-5,8-9,16-18H2,1-3H3