ethyl 4-(2-nitrophenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 4-(2-nitrophenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(2-nitrophenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(2-nitrophenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-nitrophenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(2-nitrophenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C25H20N4O4 MolecularWeight: 440.4507

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2NC3=CC=CC=C3N2C1C4=CC=CC=C4[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N=C2NC3=CC=CC=C3N2C1C4=CC=CC=C4[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O4/c1-2-33-24(30)21-22(16-10-4-3-5-11-16)27-25-26-18-13-7-9-15-20(18)28(25)23(21)17-12-6-8-14-19(17)29(31)32/h3-15,23H,2H2,1H3,(H,26,27)