2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-[2-(4-nitrophenyl)ethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-[2-(4-nitrophenyl)ethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-4-[2-(4-nitrophenyl)ethoxy]-4-oxo-butanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-[2-(4-nitrophenyl)ethoxy]-4-oxobutanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-[2-(4-nitrophenyl)ethoxy]-4-oxobutanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-4-keto-4-[2-(4-nitrophenyl)ethoxy]butyric acid Formula: C17H22N2O8 MolecularWeight: 382.36518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OCCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)OCCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H22N2O8/c1-17(2,3)27-16(23)18-13(15(21)22)10-14(20)26-9-8-11-4-6-12(7-5-11)19(24)25/h4-7,13H,8-10H2,1-3H3,(H,18,23)(H,21,22)