2-(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile

Systemtic Name: 2-(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile Openeye Name: 2-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile CAS Name: 2-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile IUPAC Name: 2-(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile Traditional Name: 2-(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)-3,4-dihydro-1H-isoquinoline-5-carbonitrile Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C=CC=C4C3)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)N3CCC4=C(C=CC=C4C3)C#N)OC

InChI

InChI=1S/C20H18N4O3/c1-26-17-8-15-16(9-18(17)27-2)22-20(23-19(15)25)24-7-6-14-12(10-21)4-3-5-13(14)11-24/h3-5,8-9H,6-7,11H2,1-2H3,(H,22,23,25)