ethyl 1-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-methyl-1-oxo-isoquinoline-4-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(2-methyl-1-oxo-4-isoquinolinyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methyl-1-oxoisoquinoline-4-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(1-keto-2-methyl-isoquinoline-4-carbonyl)isonipecotic acid ethyl ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H22N2O4/c1-3-25-19(24)13-8-10-21(11-9-13)18(23)16-12-20(2)17(22)15-7-5-4-6-14(15)16/h4-7,12-13H,3,8-11H2,1-2H3