(2,4,6-trinitrophenyl) 2-(benzimidazol-1-yl)ethanoate

Systemtic Name: (2,4,6-trinitrophenyl) 2-(benzimidazol-1-yl)ethanoate Openeye Name: (2,4,6-trinitrophenyl) 2-(benzimidazol-1-yl)acetate CAS Name: 2-(1-benzimidazolyl)acetic acid (2,4,6-trinitrophenyl) ester IUPAC Name: (2,4,6-trinitrophenyl) 2-(benzimidazol-1-yl)acetate Traditional Name: 2-(benzimidazol-1-yl)acetic acid picryl ester Formula: C15H9N5O8 MolecularWeight: 387.26066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC(=O)OC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC(=O)OC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N5O8/c21-14(7-17-8-16-10-3-1-2-4-11(10)17)28-15-12(19(24)25)5-9(18(22)23)6-13(15)20(26)27/h1-6,8H,7H2