(4-nitrophenyl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-propanoate

Systemtic Name: (4-nitrophenyl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-propanoate Openeye Name: (4-nitrophenyl) (2R)-2-(tert-butoxycarbonylamino)-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylpropanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-mercapto-propionic acid (4-nitrophenyl) ester Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CS)C(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CS)C(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O6S/c1-14(2,3)22-13(18)15-11(8-23)12(17)21-10-6-4-9(5-7-10)16(19)20/h4-7,11,23H,8H2,1-3H3,(H,15,18)/t11-/m0/s1