(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-nitrophenyl)-3-oxidanyl-propanoic acid

Systemtic Name: (2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-nitrophenyl)-3-oxidanyl-propanoic acid Openeye Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(2-nitrophenyl)propanoic acid CAS Name: (2S,3R)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid IUPAC Name: (2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-nitrophenyl)propanoic acid Traditional Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(2-nitrophenyl)propionic acid Formula: C14H18N2O7 MolecularWeight: 326.30192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O7/c1-14(2,3)23-13(20)15-10(12(18)19)11(17)8-6-4-5-7-9(8)16(21)22/h4-7,10-11,17H,1-3H3,(H,15,20)(H,18,19)/t10-,11+/m0/s1