ethyl 2,4-dimethyl-5-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(1-oxo-2-isoquinolyl)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(1-oxoisoquinolin-2-yl)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(1-keto-2-isoquinolyl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2C=CC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2C=CC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C20H20N2O4/c1-4-26-20(25)17-12(2)18(21-13(17)3)16(23)11-22-10-9-14-7-5-6-8-15(14)19(22)24/h5-10,21H,4,11H2,1-3H3