tert-butyl 4-[[methoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-3-nitro-benzoate

Systemtic Name: tert-butyl 4-[[methoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-3-nitro-benzoate Openeye Name: tert-butyl 4-[[tert-butoxycarbonyl(methoxycarbonyl)amino]methyl]-3-nitro-benzoate CAS Name: 4-[[methoxycarbonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-3-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[methoxycarbonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-3-nitrobenzoate Traditional Name: 4-[[tert-butoxycarbonyl(carbomethoxy)amino]methyl]-3-nitro-benzoic acid tert-butyl ester Formula: C19H26N2O8 MolecularWeight: 410.41834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O8/c1-18(2,3)28-15(22)12-8-9-13(14(10-12)21(25)26)11-20(16(23)27-7)17(24)29-19(4,5)6/h8-10H,11H2,1-7H3