[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-(1H-imidazol-2-yl)benzoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-(1H-imidazol-2-yl)benzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 4-(1H-imidazol-2-yl)benzoate CAS Name: 4-(1H-imidazol-2-yl)benzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 4-(1H-imidazol-2-yl)benzoate Traditional Name: 4-(1H-imidazol-2-yl)benzoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C18H13N3O5 MolecularWeight: 351.31292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC=C(C=C2)C3=NC=CN3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC=C(C=C2)C3=NC=CN3

InChI

InChI=1S/C18H13N3O5/c22-16(14-2-1-3-15(10-14)21(24)25)11-26-18(23)13-6-4-12(5-7-13)17-19-8-9-20-17/h1-10H,11H2,(H,19,20)