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

Systemtic Name: ethyl (2S)-4-methyl-2-(3-nitrophenyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl (2S)-4-methyl-2-(3-nitrophenyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: (2S)-4-methyl-2-(3-nitrophenyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S)-4-methyl-2-(3-nitrophenyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: (2S)-4-methyl-2-(3-nitrophenyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C3=CC=CC=C3NC2=NC1C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N2C3=CC=CC=C3NC2=N[C@H]1C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N4O4/c1-3-28-19(25)17-12(2)23-16-10-5-4-9-15(16)21-20(23)22-18(17)13-7-6-8-14(11-13)24(26)27/h4-11,18H,3H2,1-2H3,(H,21,22)/t18-/m0/s1