methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(5-nitropyridin-2-yl)propanoate

Systemtic Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(5-nitropyridin-2-yl)propanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3-(5-nitro-2-pyridyl)propanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(5-nitro-2-pyridinyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(5-nitropyridin-2-yl)propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(5-nitro-2-pyridyl)propionic acid methyl ester Formula: C14H19N3O6 MolecularWeight: 325.31716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=NC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=NC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H19N3O6/c1-14(2,3)23-13(19)16-11(12(18)22-4)7-9-5-6-10(8-15-9)17(20)21/h5-6,8,11H,7H2,1-4H3,(H,16,19)