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

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 4-methylpentanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 4-methylpentanoate CAS Name: 4-methylpentanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 4-methylpentanoate Traditional Name: 4-methylvaleric acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c1-9(2)3-6-13(17)21-8-11-5-4-10(14(15)18)7-12(11)16(19)20/h4-5,7,9H,3,6,8H2,1-2H3,(H2,15,18)