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

Systemtic Name: 2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 3-phenyl-2-[[2-(p-tolylsulfonylamino)acetyl]amino]propanoic acid CAS Name: 2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 3-phenyl-2-[[2-(tosylamino)acetyl]amino]propionic acid Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H20N2O5S/c1-13-7-9-15(10-8-13)26(24,25)19-12-17(21)20-16(18(22)23)11-14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3,(H,20,21)(H,22,23)