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

Systemtic Name: ethyl 1-[3-(3-chlorophenyl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[3-(3-chlorophenyl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate CAS Name: 1-[3-(3-chlorophenyl)-3-(1-ethyl-3-indolyl)-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(3-chlorophenyl)-3-(1-ethylindol-3-yl)propanoyl]piperidine-3-carboxylate Traditional Name: 1-[3-(3-chlorophenyl)-3-(1-ethylindol-3-yl)propanoyl]nipecotic acid ethyl ester Formula: C27H31ClN2O3 MolecularWeight: 466.99964

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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(=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H31ClN2O3/c1-3-29-18-24(22-12-5-6-13-25(22)29)23(19-9-7-11-21(28)15-19)16-26(31)30-14-8-10-20(17-30)27(32)33-4-2/h5-7,9,11-13,15,18,20,23H,3-4,8,10,14,16-17H2,1-2H3