2-[[4-[(2E)-2-(anthracen-9-ylmethylidene)hydrazinyl]-3-nitro-phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[4-[(2E)-2-(anthracen-9-ylmethylidene)hydrazinyl]-3-nitro-phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[4-[(2E)-2-(9-anthrylmethylene)hydrazino]-3-nitro-phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[4-[(2E)-2-(9-anthracenylmethylidene)hydrazinyl]-3-nitrophenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[4-[(2E)-2-(anthracen-9-ylmethylidene)hydrazinyl]-3-nitrophenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[4-[(N'E)-N'-(9-anthrylmethylene)hydrazino]-3-nitro-phenyl]sulfonylamino]benzoic acid Formula: C28H20N4O6S MolecularWeight: 540.5466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=NNC4=C(C=C(C=C4)S(=O)(=O)NC5=CC=CC=C5C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=N/NC4=C(C=C(C=C4)S(=O)(=O)NC5=CC=CC=C5C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C28H20N4O6S/c33-28(34)23-11-5-6-12-25(23)31-39(37,38)20-13-14-26(27(16-20)32(35)36)30-29-17-24-21-9-3-1-7-18(21)15-19-8-2-4-10-22(19)24/h1-17,30-31H,(H,33,34)/b29-17+