methyl 5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-2-nitro-benzoate

Systemtic Name: methyl 5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-2-nitro-benzoate Openeye Name: methyl 5-[(tert-butoxycarbonylamino)methyl]-2-nitro-benzoate CAS Name: 5-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-2-nitrobenzoate Traditional Name: 5-[(tert-butoxycarbonylamino)methyl]-2-nitro-benzoic acid methyl ester Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H18N2O6/c1-14(2,3)22-13(18)15-8-9-5-6-11(16(19)20)10(7-9)12(17)21-4/h5-7H,8H2,1-4H3,(H,15,18)