ethyl 2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-3-nitro-benzoate

Systemtic Name: ethyl 2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]-3-nitro-benzoate Openeye Name: ethyl 2-[benzyl(tert-butoxycarbonyl)amino]-3-nitro-benzoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-nitrobenzoate Traditional Name: 2-[benzyl(tert-butoxycarbonyl)amino]-3-nitro-benzoic acid ethyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])N(CC2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])N(CC2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H24N2O6/c1-5-28-19(24)16-12-9-13-17(23(26)27)18(16)22(20(25)29-21(2,3)4)14-15-10-7-6-8-11-15/h6-13H,5,14H2,1-4H3