(2S)-4-methyl-2-[2-(4-nitrophenyl)ethanoylamino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[2-(4-nitrophenyl)ethanoylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]pentanoic acid CAS Name: (2S)-4-methyl-2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]pentanoic acid Traditional Name: (2S)-4-methyl-2-[[2-(4-nitrophenyl)acetyl]amino]valeric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-9(2)7-12(14(18)19)15-13(17)8-10-3-5-11(6-4-10)16(20)21/h3-6,9,12H,7-8H2,1-2H3,(H,15,17)(H,18,19)/t12-/m0/s1