ethyl 1-[3-[[(3-chlorophenyl)methylamino]methyl]-8-methyl-quinolin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[[(3-chlorophenyl)methylamino]methyl]-8-methyl-quinolin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[[(3-chlorophenyl)methylamino]methyl]-8-methyl-2-quinolyl]piperidine-4-carboxylate CAS Name: 1-[3-[[(3-chlorophenyl)methylamino]methyl]-8-methyl-2-quinolinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[(3-chlorophenyl)methylamino]methyl]-8-methylquinolin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[[(3-chlorobenzyl)amino]methyl]-8-methyl-2-quinolyl]isonipecotic acid ethyl ester Formula: C26H30ClN3O2 MolecularWeight: 451.9883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=C3C=CC=C(C3=N2)C)CNCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=C3C=CC=C(C3=N2)C)CNCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H30ClN3O2/c1-3-32-26(31)20-10-12-30(13-11-20)25-22(15-21-8-4-6-18(2)24(21)29-25)17-28-16-19-7-5-9-23(27)14-19/h4-9,14-15,20,28H,3,10-13,16-17H2,1-2H3