2-[(4-hydroxyphenyl)methylsulfanylcarbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(4-hydroxyphenyl)methylsulfanylcarbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[(4-hydroxyphenyl)methylsulfanylcarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[(4-hydroxyphenyl)methylthio]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(4-hydroxyphenyl)methylsulfanylcarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[(4-hydroxybenzyl)thio]carbonylamino]-3-phenyl-propionic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)SCC2=CC=C(C=C2)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)SCC2=CC=C(C=C2)O

InChI

InChI=1S/C17H17NO4S/c19-14-8-6-13(7-9-14)11-23-17(22)18-15(16(20)21)10-12-4-2-1-3-5-12/h1-9,15,19H,10-11H2,(H,18,22)(H,20,21)