[2-[[2-(4-methylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: [2-[[2-(4-methylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl] 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: [2-[2-(4-methylphenoxy)anilino]-2-oxo-ethyl] 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid [2-[2-(4-methylphenoxy)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylphenoxy)anilino]-2-oxoethyl] 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid [2-keto-2-[2-(4-methylphenoxy)anilino]ethyl] ester Formula: C22H19ClN2O6S MolecularWeight: 474.91406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)Cl

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)Cl

InChI

InChI=1S/C22H19ClN2O6S/c1-14-6-8-15(9-7-14)31-20-5-3-2-4-19(20)25-21(26)13-30-22(27)17-12-16(32(24,28)29)10-11-18(17)23/h2-12H,13H2,1H3,(H,25,26)(H2,24,28,29)