methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(2-nitrophenyl)pentanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(2-nitrophenyl)pentanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-5-(2-nitrophenyl)pentanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(2-nitrophenyl)pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(2-nitrophenyl)pentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-(2-nitrophenyl)valeric acid methyl ester Formula: C17H24N2O6 MolecularWeight: 352.38226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC1=CC=CC=C1[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCC1=CC=CC=C1[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H24N2O6/c1-17(2,3)25-16(21)18-13(15(20)24-4)10-7-9-12-8-5-6-11-14(12)19(22)23/h5-6,8,11,13H,7,9-10H2,1-4H3,(H,18,21)/t13-/m0/s1