2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitro-phenyl]ethanoic acid

Systemtic Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitro-phenyl]ethanoic acid Openeye Name: 2-[4-(tert-butoxycarbonylamino)-2-nitro-phenyl]acetic acid CAS Name: 2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-nitrophenyl]acetic acid IUPAC Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-nitrophenyl]acetic acid Traditional Name: 2-[4-(tert-butoxycarbonylamino)-2-nitro-phenyl]acetic acid Formula: C13H16N2O6 MolecularWeight: 296.27594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=C(C=C1)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=C(C=C1)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O6/c1-13(2,3)21-12(18)14-9-5-4-8(6-11(16)17)10(7-9)15(19)20/h4-5,7H,6H2,1-3H3,(H,14,18)(H,16,17)