(4-nitrophenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate

Systemtic Name: (4-nitrophenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Openeye Name: (4-nitrophenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate CAS Name: 4,5-dimethoxy-2-[(2-methyl-1-oxopropyl)amino]benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Traditional Name: 2-(isobutyrylamino)-4,5-dimethoxy-benzoic acid (4-nitrobenzyl) ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H22N2O7/c1-12(2)19(23)21-16-10-18(28-4)17(27-3)9-15(16)20(24)29-11-13-5-7-14(8-6-13)22(25)26/h5-10,12H,11H2,1-4H3,(H,21,23)