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

Systemtic Name: methyl (2R,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-nitrophenyl)-3-oxidanyl-propanoate Openeye Name: methyl (2R,3S)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(3-nitrophenyl)propanoate CAS Name: (2R,3S)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(3-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl (2R,3S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-nitrophenyl)propanoate Traditional Name: (2R,3S)-2-(tert-butoxycarbonylamino)-3-hydroxy-3-(3-nitrophenyl)propionic acid methyl ester Formula: C15H20N2O7 MolecularWeight: 340.3285

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O7/c1-15(2,3)24-14(20)16-11(13(19)23-4)12(18)9-6-5-7-10(8-9)17(21)22/h5-8,11-12,18H,1-4H3,(H,16,20)/t11-,12+/m1/s1