methyl 3-(4-methoxy-3-nitro-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl 3-(4-methoxy-3-nitro-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3-(4-methoxy-3-nitro-phenyl)propanoate CAS Name: 3-(4-methoxy-3-nitrophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methoxy-3-nitrophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(4-methoxy-3-nitro-phenyl)propionic acid methyl ester Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O7/c1-16(2,3)25-15(20)17-11(14(19)24-5)8-10-6-7-13(23-4)12(9-10)18(21)22/h6-7,9,11H,8H2,1-5H3,(H,17,20)