(2R)-2-[(4-hydroxyphenyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-sulfanyl-propanoic acid

Systemtic Name: (2R)-2-[(4-hydroxyphenyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-sulfanyl-propanoic acid Openeye Name: (2R)-2-(N-tert-butoxycarbonyl-4-hydroxy-anilino)-3-sulfanyl-propanoic acid CAS Name: (2R)-2-(4-hydroxy-N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino)-3-mercaptopropanoic acid IUPAC Name: (2R)-2-[4-hydroxy-N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]-3-sulfanylpropanoic acid Traditional Name: (2R)-2-(N-tert-butoxycarbonyl-4-hydroxy-anilino)-3-mercapto-propionic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=CC=C(C=C1)O)C(CS)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=CC=C(C=C1)O)[C@@H](CS)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-14(2,3)20-13(19)15(11(8-21)12(17)18)9-4-6-10(16)7-5-9/h4-7,11,16,21H,8H2,1-3H3,(H,17,18)/t11-/m0/s1