ethyl 3-(6-nitro-1H-benzimidazol-2-yl)benzoate

Systemtic Name: ethyl 3-(6-nitro-1H-benzimidazol-2-yl)benzoate Openeye Name: ethyl 3-(6-nitro-1H-benzimidazol-2-yl)benzoate CAS Name: 3-(6-nitro-1H-benzimidazol-2-yl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(6-nitro-1H-benzimidazol-2-yl)benzoate Traditional Name: 3-(6-nitro-1H-benzimidazol-2-yl)benzoic acid ethyl ester Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c1-2-23-16(20)11-5-3-4-10(8-11)15-17-13-7-6-12(19(21)22)9-14(13)18-15/h3-9H,2H2,1H3,(H,17,18)