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

Systemtic Name: ethyl 4-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(2-isobutyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[[6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-4-isoquinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6,7-dimethoxy-2-(2-methylpropyl)-1-oxoisoquinoline-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-(2-isobutyl-1-keto-6,7-dimethoxy-isoquinoline-4-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C23H31N3O6 MolecularWeight: 445.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)CC(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)CC(C)C

InChI

InChI=1S/C23H31N3O6/c1-6-32-23(29)25-9-7-24(8-10-25)22(28)18-14-26(13-15(2)3)21(27)17-12-20(31-5)19(30-4)11-16(17)18/h11-12,14-15H,6-10,13H2,1-5H3