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

Systemtic Name: 3-(4-hydroxyphenyl)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-[[2-(p-tolylsulfonylamino)acetyl]amino]propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[[2-(tosylamino)acetyl]amino]propionic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O6S/c1-12-2-8-15(9-3-12)27(25,26)19-11-17(22)20-16(18(23)24)10-13-4-6-14(21)7-5-13/h2-9,16,19,21H,10-11H2,1H3,(H,20,22)(H,23,24)