(4-aminocarbonyl-2-nitro-phenyl)methyl 2-methylbutanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 2-methylbutanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 2-methylbutanoate CAS Name: 2-methylbutanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 2-methylbutanoate Traditional Name: 2-methylbutyric acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C(=O)OCC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5/c1-3-8(2)13(17)20-7-10-5-4-9(12(14)16)6-11(10)15(18)19/h4-6,8H,3,7H2,1-2H3,(H2,14,16)