2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-methyl-amino]benzoic acid

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-methyl-amino]benzoic acid Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methyl-amino]benzoic acid CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]benzoic acid IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)-methylamino]benzoic acid Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)-methyl-amino]benzoic acid Formula: C15H12N2O4S MolecularWeight: 316.33178

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C15H12N2O4S/c1-17(12-8-4-2-6-10(12)15(18)19)14-11-7-3-5-9-13(11)22(20,21)16-14/h2-9H,1H3,(H,18,19)