3-methylbutyl 4-[2-(2-nitrophenoxy)ethanoylamino]benzoate

Systemtic Name: 3-methylbutyl 4-[2-(2-nitrophenoxy)ethanoylamino]benzoate Openeye Name: isopentyl 4-[[2-(2-nitrophenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[[2-(2-nitrophenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-nitrophenoxy)acetyl]amino]benzoic acid isoamyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-14(2)11-12-27-20(24)15-7-9-16(10-8-15)21-19(23)13-28-18-6-4-3-5-17(18)22(25)26/h3-10,14H,11-13H2,1-2H3,(H,21,23)