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

Systemtic Name: 3-[4-[2-[(4-methylphenyl)sulfonylamino]ethanoyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-(p-tolylsulfonylamino)acetyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(4-methylphenyl)sulfonylamino]acetyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-(tosylamino)acetyl]phenyl]propionic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C18H19NO5S/c1-13-2-9-16(10-3-13)25(23,24)19-12-17(20)15-7-4-14(5-8-15)6-11-18(21)22/h2-5,7-10,19H,6,11-12H2,1H3,(H,21,22)