2-(3,4-dimethylphenyl)-N-(2-methoxyethyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-(2-methoxyethyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-(2-methoxyethyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-(2-methoxyethyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-(2-methoxyethyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-1-keto-N-(2-methoxyethyl)isoquinoline-4-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCOC)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCOC)C

InChI

InChI=1S/C21H22N2O3/c1-14-8-9-16(12-15(14)2)23-13-19(20(24)22-10-11-26-3)17-6-4-5-7-18(17)21(23)25/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)