tert-butyl 3-[[methyl(phenylmethoxycarbonyl)amino]methyl]-4-nitro-benzoate

Systemtic Name: tert-butyl 3-[[methyl(phenylmethoxycarbonyl)amino]methyl]-4-nitro-benzoate Openeye Name: tert-butyl 3-[[benzyloxycarbonyl(methyl)amino]methyl]-4-nitro-benzoate CAS Name: 3-[[methyl(phenylmethoxycarbonyl)amino]methyl]-4-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[methyl(phenylmethoxycarbonyl)amino]methyl]-4-nitrobenzoate Traditional Name: 3-[[carbobenzoxy(methyl)amino]methyl]-4-nitro-benzoic acid tert-butyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CN(C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CN(C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O6/c1-21(2,3)29-19(24)16-10-11-18(23(26)27)17(12-16)13-22(4)20(25)28-14-15-8-6-5-7-9-15/h5-12H,13-14H2,1-4H3