ethyl 3-[[3-(4-nitro-1H-benzimidazol-2-yl)phenyl]sulfonylamino]benzoate

Systemtic Name: ethyl 3-[[3-(4-nitro-1H-benzimidazol-2-yl)phenyl]sulfonylamino]benzoate Openeye Name: ethyl 3-[[3-(4-nitro-1H-benzimidazol-2-yl)phenyl]sulfonylamino]benzoate CAS Name: 3-[[3-(4-nitro-1H-benzimidazol-2-yl)phenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[3-(4-nitro-1H-benzimidazol-2-yl)phenyl]sulfonylamino]benzoate Traditional Name: 3-[[3-(4-nitro-1H-benzimidazol-2-yl)phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C22H18N4O6S MolecularWeight: 466.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C3=NC4=C(N3)C=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C3=NC4=C(N3)C=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O6S/c1-2-32-22(27)15-7-3-8-16(12-15)25-33(30,31)17-9-4-6-14(13-17)21-23-18-10-5-11-19(26(28)29)20(18)24-21/h3-13,25H,2H2,1H3,(H,23,24)