(4-nitrophenyl) (2S)-2-acetamido-4-methyl-pentanoate

Systemtic Name: (4-nitrophenyl) (2S)-2-acetamido-4-methyl-pentanoate Openeye Name: (4-nitrophenyl) (2S)-2-acetamido-4-methyl-pentanoate CAS Name: (2S)-2-acetamido-4-methylpentanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (2S)-2-acetamido-4-methylpentanoate Traditional Name: (2S)-2-acetamido-4-methyl-valeric acid (4-nitrophenyl) ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C14H18N2O5/c1-9(2)8-13(15-10(3)17)14(18)21-12-6-4-11(5-7-12)16(19)20/h4-7,9,13H,8H2,1-3H3,(H,15,17)/t13-/m0/s1