3-methyl-2-[[4-[(4-methylphenyl)carbonylamino]phenyl]sulfonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[4-[(4-methylphenyl)carbonylamino]phenyl]sulfonylamino]butanoic acid Openeye Name: 3-methyl-2-[[4-[(4-methylbenzoyl)amino]phenyl]sulfonylamino]butanoic acid CAS Name: 3-methyl-2-[[4-[[(4-methylphenyl)-oxomethyl]amino]phenyl]sulfonylamino]butanoic acid IUPAC Name: 3-methyl-2-[[4-[(4-methylbenzoyl)amino]phenyl]sulfonylamino]butanoic acid Traditional Name: 3-methyl-2-[[4-(p-toluoylamino)phenyl]sulfonylamino]butyric acid Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C19H22N2O5S/c1-12(2)17(19(23)24)21-27(25,26)16-10-8-15(9-11-16)20-18(22)14-6-4-13(3)5-7-14/h4-12,17,21H,1-3H3,(H,20,22)(H,23,24)