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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=CC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CN2C(=CC3=CC=CC=C3C2=O)C

InChI

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