2-methylpropyl 4-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]benzoate Openeye Name: isobutyl 4-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[2-(3-methyl-4-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]benzoic acid isobutyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-13(2)11-28-20(24)15-4-6-16(7-5-15)21-19(23)12-27-17-8-9-18(22(25)26)14(3)10-17/h4-10,13H,11-12H2,1-3H3,(H,21,23)