2-[[4-[2-(5-fluoranyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-3-nitro-phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[4-[2-(5-fluoranyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-3-nitro-phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[4-[2-(5-fluoro-2-oxo-indol-3-yl)hydrazino]-3-nitro-phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[4-[(5-fluoro-2-oxo-3-indolyl)hydrazo]-3-nitrophenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[4-[2-(5-fluoro-2-oxoindol-3-yl)hydrazinyl]-3-nitrophenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[4-[N'-(5-fluoro-2-keto-indol-3-yl)hydrazino]-3-nitro-phenyl]sulfonylamino]benzoic acid Formula: C21H14FN5O7S MolecularWeight: 499.428563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)NNC3=C4C=C(C=CC4=NC3=O)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)NNC3=C4C=C(C=CC4=NC3=O)F)[N+](=O)[O-]

InChI

InChI=1S/C21H14FN5O7S/c22-11-5-7-15-14(9-11)19(20(28)23-15)25-24-17-8-6-12(10-18(17)27(31)32)35(33,34)26-16-4-2-1-3-13(16)21(29)30/h1-10,24,26H,(H,29,30)(H,23,25,28)