6,7-dimethoxy-2-(4-methylphenyl)carbonyl-1H-isoquinoline-1-carbonitrile

Systemtic Name: 6,7-dimethoxy-2-(4-methylphenyl)carbonyl-1H-isoquinoline-1-carbonitrile Openeye Name: 6,7-dimethoxy-2-(4-methylbenzoyl)-1H-isoquinoline-1-carbonitrile CAS Name: 6,7-dimethoxy-2-[(4-methylphenyl)-oxomethyl]-1H-isoquinoline-1-carbonitrile IUPAC Name: 6,7-dimethoxy-2-(4-methylbenzoyl)-1H-isoquinoline-1-carbonitrile Traditional Name: 6,7-dimethoxy-2-p-toluoyl-1H-isoquinoline-1-carbonitrile Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C=CC3=CC(=C(C=C3C2C#N)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C=CC3=CC(=C(C=C3C2C#N)OC)OC

InChI

InChI=1S/C20H18N2O3/c1-13-4-6-14(7-5-13)20(23)22-9-8-15-10-18(24-2)19(25-3)11-16(15)17(22)12-21/h4-11,17H,1-3H3