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

Systemtic Name: 2-formamido-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]propanoic acid Openeye Name: 2-formamido-3-[4-(p-tolylsulfonylamino)phenyl]propanoic acid CAS Name: 2-formamido-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]propanoic acid IUPAC Name: 2-formamido-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]propanoic acid Traditional Name: 2-formamido-3-[4-(tosylamino)phenyl]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)CC(C(=O)O)NC=O

Isomeric SMILES

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

InChI

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