4-(1,3-benzodioxol-5-yl)-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C14H11N3O4 MolecularWeight: 285.25484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H11N3O4/c1-16-12(9(6-15)13(18)17(2)14(16)19)8-3-4-10-11(5-8)21-7-20-10/h3-5H,7H2,1-2H3