(3-nitrophenyl)methyl 2-(benzimidazol-1-yl)ethanoate

Systemtic Name: (3-nitrophenyl)methyl 2-(benzimidazol-1-yl)ethanoate Openeye Name: (3-nitrophenyl)methyl 2-(benzimidazol-1-yl)acetate CAS Name: 2-(1-benzimidazolyl)acetic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2-(benzimidazol-1-yl)acetate Traditional Name: 2-(benzimidazol-1-yl)acetic acid (3-nitrobenzyl) ester Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c20-16(9-18-11-17-14-6-1-2-7-15(14)18)23-10-12-4-3-5-13(8-12)19(21)22/h1-8,11H,9-10H2