2-[[2-(2-cycloheptylidenehydrazinyl)-5-nitro-phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[2-(2-cycloheptylidenehydrazinyl)-5-nitro-phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[2-(2-cycloheptylidenehydrazino)-5-nitro-phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[2-(2-cycloheptylidenehydrazinyl)-5-nitrophenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[2-(2-cycloheptylidenehydrazinyl)-5-nitrophenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[2-(N'-cycloheptylidenehydrazino)-5-nitro-phenyl]sulfonylamino]benzoic acid Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=CC=C3C(=O)O)CC1

Isomeric SMILES

C1CCCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=CC=C3C(=O)O)CC1

InChI

InChI=1S/C20H22N4O6S/c25-20(26)16-9-5-6-10-17(16)23-31(29,30)19-13-15(24(27)28)11-12-18(19)22-21-14-7-3-1-2-4-8-14/h5-6,9-13,22-23H,1-4,7-8H2,(H,25,26)