methyl 1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]-4-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]-4-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]piperidine-4-carboxylate Openeye Name: methyl 4-[(2-anilino-2-oxo-ethyl)amino]-1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]piperidine-4-carboxylate CAS Name: 4-[(2-anilino-2-oxoethyl)amino]-1-[2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(2-anilino-2-oxoethyl)amino]-1-[2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]piperidine-4-carboxylate Traditional Name: 4-[(2-anilino-2-keto-ethyl)amino]-1-[2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]isonipecotic acid methyl ester Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)(C(=O)OC)NCC(=O)NC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)(C(=O)OC)NCC(=O)NC4=CC=CC=C4)O

InChI

InChI=1S/C27H32N4O5/c1-35-20-8-9-23-22(16-20)21(10-13-28-23)24(32)18-31-14-11-27(12-15-31,26(34)36-2)29-17-25(33)30-19-6-4-3-5-7-19/h3-10,13,16,24,29,32H,11-12,14-15,17-18H2,1-2H3,(H,30,33)