2-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]pentanoic acid

Systemtic Name: 2-methyl-2-[(4-methyl-3-nitro-phenyl)carbonylamino]pentanoic acid Openeye Name: 2-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]pentanoic acid CAS Name: 2-methyl-2-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: 2-methyl-2-[(4-methyl-3-nitrobenzoyl)amino]pentanoic acid Traditional Name: 2-methyl-2-[(4-methyl-3-nitro-benzoyl)amino]valeric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c1-4-7-14(3,13(18)19)15-12(17)10-6-5-9(2)11(8-10)16(20)21/h5-6,8H,4,7H2,1-3H3,(H,15,17)(H,18,19)