ethyl 1-(6-methylquinolin-4-yl)carbonyl-4-(3-phenylpropyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(6-methylquinolin-4-yl)carbonyl-4-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(6-methylquinoline-4-carbonyl)-4-(3-phenylpropyl)piperidine-4-carboxylate CAS Name: 1-[(6-methyl-4-quinolinyl)-oxomethyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(6-methylquinoline-4-carbonyl)-4-(3-phenylpropyl)piperidine-4-carboxylate Traditional Name: 1-(6-methylquinoline-4-carbonyl)-4-(3-phenylpropyl)isonipecotic acid ethyl ester Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=C3C=C(C=CC3=NC=C2)C)CCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=C3C=C(C=CC3=NC=C2)C)CCCC4=CC=CC=C4

InChI

InChI=1S/C28H32N2O3/c1-3-33-27(32)28(14-7-10-22-8-5-4-6-9-22)15-18-30(19-16-28)26(31)23-13-17-29-25-12-11-21(2)20-24(23)25/h4-6,8-9,11-13,17,20H,3,7,10,14-16,18-19H2,1-2H3