(4-bromophenyl)methyl 4-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate

Systemtic Name: (4-bromophenyl)methyl 4-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate Openeye Name: (4-bromophenyl)methyl 4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate CAS Name: 4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate Traditional Name: 2-keto-4-(3-nitrophenyl)-3,4-dihydro-1H-pyrimidine-6-carboxylic acid (4-bromobenzyl) ester Formula: C18H14BrN3O5 MolecularWeight: 432.22486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2C=C(NC(=O)N2)C(=O)OCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2C=C(NC(=O)N2)C(=O)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3O5/c19-13-6-4-11(5-7-13)10-27-17(23)16-9-15(20-18(24)21-16)12-2-1-3-14(8-12)22(25)26/h1-9,15H,10H2,(H2,20,21,24)