ethyl 1-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(3-methyl-1-oxidanylidene-isoquinolin-2-yl)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(3-methyl-1-oxo-2-isoquinolyl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(3-methyl-1-oxo-2-isoquinolinyl)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-methyl-1-oxoisoquinolin-2-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(1-keto-3-methyl-2-isoquinolyl)acetyl]isonipecotic acid ethyl ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C(=CC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C(=CC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C20H24N2O4/c1-3-26-20(25)15-8-10-21(11-9-15)18(23)13-22-14(2)12-16-6-4-5-7-17(16)19(22)24/h4-7,12,15H,3,8-11,13H2,1-2H3