[1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl] 6-methoxyquinoline-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl] 6-methoxyquinoline-2-carboxylate Openeye Name: [2-(4-benzyl-1-piperidyl)-1-methyl-2-oxo-ethyl] 6-methoxyquinoline-2-carboxylate CAS Name: 6-methoxy-2-quinolinecarboxylic acid [1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]propan-2-yl] ester IUPAC Name: [1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl] 6-methoxyquinoline-2-carboxylate Traditional Name: 6-methoxyquinaldic acid [2-(4-benzylpiperidino)-2-keto-1-methyl-ethyl] ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)OC(=O)C3=NC4=C(C=C3)C=C(C=C4)OC

Isomeric SMILES

CC(C(=O)N1CCC(CC1)CC2=CC=CC=C2)OC(=O)C3=NC4=C(C=C3)C=C(C=C4)OC

InChI

InChI=1S/C26H28N2O4/c1-18(25(29)28-14-12-20(13-15-28)16-19-6-4-3-5-7-19)32-26(30)24-10-8-21-17-22(31-2)9-11-23(21)27-24/h3-11,17-18,20H,12-16H2,1-2H3