ethyl 4-(4-dimethylaminophenyl)-6-methyl-2-nitramido-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-dimethylaminophenyl)-6-methyl-2-nitramido-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-dimethylaminophenyl)-6-methyl-2-nitramido-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(4-dimethylaminophenyl)-6-methyl-2-nitramido-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-dimethylaminophenyl)-6-methyl-2-nitramido-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(4-dimethylaminophenyl)-6-methyl-2-nitramido-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=CC=C(C=C2)N(C)C)N[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=CC=C(C=C2)N(C)C)N[N+](=O)[O-])C

InChI

InChI=1S/C16H21N5O4/c1-5-25-15(22)13-10(2)17-16(19-21(23)24)18-14(13)11-6-8-12(9-7-11)20(3)4/h6-9,14H,5H2,1-4H3,(H2,17,18,19)