3-(4-hydroxyphenyl)-2-[(4-methylsulfonylphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[(4-methylsulfonylphenyl)carbonylamino]propanoic acid Openeye Name: 3-(4-hydroxyphenyl)-2-[(4-methylsulfonylbenzoyl)amino]propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[(4-methylsulfonylbenzoyl)amino]propanoic acid Traditional Name: 3-(4-hydroxyphenyl)-2-[(4-mesylbenzoyl)amino]propionic acid Formula: C17H17NO6S MolecularWeight: 363.38498

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C17H17NO6S/c1-25(23,24)14-8-4-12(5-9-14)16(20)18-15(17(21)22)10-11-2-6-13(19)7-3-11/h2-9,15,19H,10H2,1H3,(H,18,20)(H,21,22)