3-[[4-[3,4-bis(oxidanyl)phenyl]-1,3-thiazol-2-yl]amino]benzoate

Systemtic Name: 3-[[4-[3,4-bis(oxidanyl)phenyl]-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 3-[[4-(3,4-dihydroxyphenyl)thiazol-2-yl]amino]benzoate CAS Name: 3-[[4-(3,4-dihydroxyphenyl)-2-thiazolyl]amino]benzoate IUPAC Name: 3-[[4-(3,4-dihydroxyphenyl)-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 3-[[4-(3,4-dihydroxyphenyl)thiazol-2-yl]amino]benzoate Formula: C16H11N2O4S- MolecularWeight: 327.33454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=CS2)C3=CC(=C(C=C3)O)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=CS2)C3=CC(=C(C=C3)O)O)C(=O)[O-]

InChI

InChI=1S/C16H12N2O4S/c19-13-5-4-9(7-14(13)20)12-8-23-16(18-12)17-11-3-1-2-10(6-11)15(21)22/h1-8,19-20H,(H,17,18)(H,21,22)/p-1