(4-nitrophenyl)methyl 2-azanyl-4-methyl-pentanoate

Systemtic Name: (4-nitrophenyl)methyl 2-azanyl-4-methyl-pentanoate Openeye Name: (4-nitrophenyl)methyl 2-amino-4-methyl-pentanoate CAS Name: 2-amino-4-methylpentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-amino-4-methylpentanoate Traditional Name: 2-amino-4-methyl-valeric acid (4-nitrobenzyl) ester Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4/c1-9(2)7-12(14)13(16)19-8-10-3-5-11(6-4-10)15(17)18/h3-6,9,12H,7-8,14H2,1-2H3