[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-[(4-methoxyphenyl)sulfamoyl]-2-oxidanyl-benzoate

Systemtic Name: [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-[(4-methoxyphenyl)sulfamoyl]-2-oxidanyl-benzoate Openeye Name: [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoate CAS Name: 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoate Traditional Name: 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid [2-keto-2-[(6-nitro-1,3-benzothiazol-2-yl)amino]ethyl] ester Formula: C23H18N4O9S2 MolecularWeight: 558.54042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O9S2/c1-35-15-5-2-13(3-6-15)26-38(33,34)16-7-9-19(28)17(11-16)22(30)36-12-21(29)25-23-24-18-8-4-14(27(31)32)10-20(18)37-23/h2-11,26,28H,12H2,1H3,(H,24,25,29)