6-(3,4-dimethoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(3,4-dimethoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(3,4-dimethoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(3,4-dimethoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(3,4-dimethoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(3,4-dimethoxyphenyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)N=CN2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)N=CN2)C#N)OC

InChI

InChI=1S/C13H11N3O3/c1-18-10-4-3-8(5-11(10)19-2)12-9(6-14)13(17)16-7-15-12/h3-5,7H,1-2H3,(H,15,16,17)