2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)-3-oxidanyl-propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-hydroxy-3-(4-nitrophenyl)propanoic acid CAS Name: 3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: 3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitrophenyl)propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-hydroxy-3-(4-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=C(C=C1)[N+](=O)[O-])O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C(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)