methyl 3-[2-[3-[(2-chloranyl-5-sulfamoyl-phenyl)carbonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(2-chloranyl-5-sulfamoyl-phenyl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(2-chloro-5-sulfamoyl-benzoyl)amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[(2-chloro-5-sulfamoylphenyl)-oxomethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(2-chloro-5-sulfamoylbenzoyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(2-chloro-5-sulfamoyl-benzoyl)amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C23H17ClN2O5S MolecularWeight: 468.90948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C#CC2=CC(=CC=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)Cl

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C#CC2=CC(=CC=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)Cl

InChI

InChI=1S/C23H17ClN2O5S/c1-31-23(28)17-6-2-4-15(12-17)8-9-16-5-3-7-18(13-16)26-22(27)20-14-19(32(25,29)30)10-11-21(20)24/h2-7,10-14H,1H3,(H,26,27)(H2,25,29,30)