ethyl 1-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(2-isobutyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carbonyl)piperidine-3-carboxylate CAS Name: 1-[[6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-4-isoquinolinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxoisoquinoline-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-(2-isobutyl-1-keto-6,7-dimethoxy-isoquinoline-4-carbonyl)nipecotic acid ethyl ester Formula: C24H32N2O6 MolecularWeight: 444.52068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)CC(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)CC(C)C

InChI

InChI=1S/C24H32N2O6/c1-6-32-24(29)16-8-7-9-25(13-16)23(28)19-14-26(12-15(2)3)22(27)18-11-21(31-5)20(30-4)10-17(18)19/h10-11,14-16H,6-9,12-13H2,1-5H3