2-(3,4-dimethoxyphenyl)carbonyl-1H-isoquinoline-1-carbonitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)carbonyl-1H-isoquinoline-1-carbonitrile Openeye Name: 2-(3,4-dimethoxybenzoyl)-1H-isoquinoline-1-carbonitrile CAS Name: 2-[(3,4-dimethoxyphenyl)-oxomethyl]-1H-isoquinoline-1-carbonitrile IUPAC Name: 2-(3,4-dimethoxybenzoyl)-1H-isoquinoline-1-carbonitrile Traditional Name: 2-veratroyl-1H-isoquinoline-1-carbonitrile Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2C#N)OC

InChI

InChI=1S/C19H16N2O3/c1-23-17-8-7-14(11-18(17)24-2)19(22)21-10-9-13-5-3-4-6-15(13)16(21)12-20/h3-11,16H,1-2H3