(2R,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)-3-oxidanyl-propanoate

Systemtic Name: (2R,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)-3-oxidanyl-propanoate Openeye Name: (2R,3S)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(4-nitrophenyl)propanoate CAS Name: (2R,3S)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-nitrophenyl)propanoate IUPAC Name: (2R,3S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)propanoate Traditional Name: (2R,3S)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(4-nitrophenyl)propionate Formula: C14H17N2O7- MolecularWeight: 325.29398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H]([C@H](C1=CC=C(C=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)8-4-6-9(7-5-8)16(21)22/h4-7,10-11,17H,1-3H3,(H,15,20)(H,18,19)/p-1/t10-,11+/m1/s1