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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC2=NS(=O)(=O)C3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NC2=NS(=O)(=O)C3=CC=CC=C32)C(=O)O

InChI

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