2,4-dimethyl-5-[(4-methylphenyl)carbonylamino]benzenesulfonic acid

Systemtic Name: 2,4-dimethyl-5-[(4-methylphenyl)carbonylamino]benzenesulfonic acid Openeye Name: 2,4-dimethyl-5-[(4-methylbenzoyl)amino]benzenesulfonic acid CAS Name: 2,4-dimethyl-5-[[(4-methylphenyl)-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 2,4-dimethyl-5-[(4-methylbenzoyl)amino]benzenesulfonic acid Traditional Name: 2,4-dimethyl-5-(p-toluoylamino)besylic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2C)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2C)C)S(=O)(=O)O

InChI

InChI=1S/C16H17NO4S/c1-10-4-6-13(7-5-10)16(18)17-14-9-15(22(19,20)21)12(3)8-11(14)2/h4-9H,1-3H3,(H,17,18)(H,19,20,21)