3-[[4-[(4-methylphenyl)sulfonylamino]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[(4-methylphenyl)sulfonylamino]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-(p-tolylsulfonylamino)benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[(4-methylphenyl)sulfonylamino]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-(tosylamino)benzoyl]amino]propionic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S/c1-12-2-8-15(9-3-12)25(23,24)19-14-6-4-13(5-7-14)17(22)18-11-10-16(20)21/h2-9,19H,10-11H2,1H3,(H,18,22)(H,20,21)