ethyl 1-[(4-oxidanylidene-1H-quinolin-2-yl)methyl]-4-(phenylmethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(4-oxidanylidene-1H-quinolin-2-yl)methyl]-4-(phenylmethyl)piperidine-4-carboxylate Openeye Name: ethyl 4-benzyl-1-[(4-oxo-1H-quinolin-2-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[(4-oxo-1H-quinolin-2-yl)methyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-1-[(4-oxo-1H-quinolin-2-yl)methyl]piperidine-4-carboxylate Traditional Name: 4-benzyl-1-[(4-keto-1H-quinolin-2-yl)methyl]isonipecotic acid ethyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CC(=O)C3=CC=CC=C3N2)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC(=O)C3=CC=CC=C3N2)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O3/c1-2-30-24(29)25(17-19-8-4-3-5-9-19)12-14-27(15-13-25)18-20-16-23(28)21-10-6-7-11-22(21)26-20/h3-11,16H,2,12-15,17-18H2,1H3,(H,26,28)