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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

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