3,4-dimethyl-5-[(4-phenoxyphenyl)sulfamoyl]benzoate

Systemtic Name: 3,4-dimethyl-5-[(4-phenoxyphenyl)sulfamoyl]benzoate Openeye Name: 3,4-dimethyl-5-[(4-phenoxyphenyl)sulfamoyl]benzoate CAS Name: 3,4-dimethyl-5-[(4-phenoxyphenyl)sulfamoyl]benzoate IUPAC Name: 3,4-dimethyl-5-[(4-phenoxyphenyl)sulfamoyl]benzoate Traditional Name: 3,4-dimethyl-5-[(4-phenoxyphenyl)sulfamoyl]benzoate Formula: C21H18NO5S- MolecularWeight: 396.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C21H19NO5S/c1-14-12-16(21(23)24)13-20(15(14)2)28(25,26)22-17-8-10-19(11-9-17)27-18-6-4-3-5-7-18/h3-13,22H,1-2H3,(H,23,24)/p-1