propyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: propyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propyl ester IUPAC Name: propyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-1,6-dihydropyrimidine-5-carboxylic acid propyl ester Formula: C17H19N3O7 MolecularWeight: 377.34866

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(N(C(=O)NC1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C)C

Isomeric SMILES

CCCOC(=O)C1=C(N(C(=O)NC1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C)C

InChI

InChI=1S/C17H19N3O7/c1-4-5-25-16(21)14-9(2)19(3)17(22)18-15(14)10-6-12-13(27-8-26-12)7-11(10)20(23)24/h6-7,15H,4-5,8H2,1-3H3,(H,18,22)