3-[[(E)-dimethylamino(pyrrol-2-ylidene)methyl]sulfamoyl]-4-(3-oxidanylphenoxy)benzoic acid

Systemtic Name: 3-[[(E)-dimethylamino(pyrrol-2-ylidene)methyl]sulfamoyl]-4-(3-oxidanylphenoxy)benzoic acid Openeye Name: 3-[[(E)-dimethylamino(pyrrol-2-ylidene)methyl]sulfamoyl]-4-(3-hydroxyphenoxy)benzoic acid CAS Name: 3-[[(E)-dimethylamino(2-pyrrolylidene)methyl]sulfamoyl]-4-(3-hydroxyphenoxy)benzoic acid IUPAC Name: 3-[[(E)-dimethylamino(pyrrol-2-ylidene)methyl]sulfamoyl]-4-(3-hydroxyphenoxy)benzoic acid Traditional Name: 3-[[(E)-dimethylamino(pyrrol-2-ylidene)methyl]sulfamoyl]-4-(3-hydroxyphenoxy)benzoic acid Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=C1C=CC=N1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC3=CC=CC(=C3)O

Isomeric SMILES

CN(C)/C(=C\1/C=CC=N1)/NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)OC3=CC=CC(=C3)O

InChI

InChI=1S/C20H19N3O6S/c1-23(2)19(16-7-4-10-21-16)22-30(27,28)18-11-13(20(25)26)8-9-17(18)29-15-6-3-5-14(24)12-15/h3-12,22,24H,1-2H3,(H,25,26)/b19-16-