(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C24H24ClN3O4 MolecularWeight: 453.91806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H24ClN3O4/c1-31-20-8-7-17-13-18(22(25)27-21(17)14-20)15-32-23(29)16-9-11-28(12-10-16)24(30)26-19-5-3-2-4-6-19/h2-8,13-14,16H,9-12,15H2,1H3,(H,26,30)