ethyl 1-[3-(3,4-dimethylphenyl)carbonyl-6,7-dimethoxy-quinolin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(3,4-dimethylphenyl)carbonyl-6,7-dimethoxy-quinolin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(3,4-dimethylbenzoyl)-6,7-dimethoxy-4-quinolyl]piperidine-4-carboxylate CAS Name: 1-[3-[(3,4-dimethylphenyl)-oxomethyl]-6,7-dimethoxy-4-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(3,4-dimethylbenzoyl)-6,7-dimethoxyquinolin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(3,4-dimethylbenzoyl)-6,7-dimethoxy-4-quinolyl]isonipecotic acid ethyl ester Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=NC3=CC(=C(C=C32)OC)OC)C(=O)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=NC3=CC(=C(C=C32)OC)OC)C(=O)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C28H32N2O5/c1-6-35-28(32)19-9-11-30(12-10-19)26-21-14-24(33-4)25(34-5)15-23(21)29-16-22(26)27(31)20-8-7-17(2)18(3)13-20/h7-8,13-16,19H,6,9-12H2,1-5H3