3-[[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]phenyl]sulfonylamino]benzoic acid Formula: C16H13NO6S MolecularWeight: 347.34252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C16H13NO6S/c18-15(19)9-6-11-4-7-14(8-5-11)24(22,23)17-13-3-1-2-12(10-13)16(20)21/h1-10,17H,(H,18,19)(H,20,21)/b9-6+