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

Systemtic Name: methyl 3-(4-hydroxyphenyl)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]propanoate Openeye Name: methyl 3-(4-hydroxyphenyl)-2-[[2-(p-tolylsulfonylamino)acetyl]amino]propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-hydroxyphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoate Traditional Name: 3-(4-hydroxyphenyl)-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(CC2=CC=C(C=C2)O)C(=O)OC

Isomeric SMILES

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

InChI

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