ethyl 1-[[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinolin-6-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinoline-6-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[3-(4-cyanophenyl)-1-oxopropyl]-3,4-dihydro-2H-quinolin-6-yl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinoline-6-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-[3-(4-cyanophenyl)propanoyl]-3,4-dihydro-2H-quinoline-6-carbonyl]nipecotic acid ethyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CCC4=CC=C(C=C4)C#N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C28H31N3O4/c1-2-35-28(34)24-6-3-15-30(19-24)27(33)23-12-13-25-22(17-23)5-4-16-31(25)26(32)14-11-20-7-9-21(18-29)10-8-20/h7-10,12-13,17,24H,2-6,11,14-16,19H2,1H3