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

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yloxy)-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C14H11N3O5 MolecularWeight: 301.25424

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H11N3O5/c1-16-12(18)9(6-15)13(17(2)14(16)19)22-8-3-4-10-11(5-8)21-7-20-10/h3-5H,7H2,1-2H3