methyl 2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]-3-oxidanyl-3-phenyl-propanoate Openeye Name: methyl 3-hydroxy-3-phenyl-2-[[2-(p-tolylsulfonylamino)acetyl]amino]propanoate CAS Name: 3-hydroxy-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-hydroxy-3-phenyl-2-[[2-(tosylamino)acetyl]amino]propionic acid methyl ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6S/c1-13-8-10-15(11-9-13)28(25,26)20-12-16(22)21-17(19(24)27-2)18(23)14-6-4-3-5-7-14/h3-11,17-18,20,23H,12H2,1-2H3,(H,21,22)