3-methyl-2-[(2-methyl-6-nitro-phenyl)carbonylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[(2-methyl-6-nitro-phenyl)carbonylamino]pentanoic acid Openeye Name: 3-methyl-2-[(2-methyl-6-nitro-benzoyl)amino]pentanoic acid CAS Name: 3-methyl-2-[[(2-methyl-6-nitrophenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[(2-methyl-6-nitrobenzoyl)amino]pentanoic acid Traditional Name: 3-methyl-2-[(2-methyl-6-nitro-benzoyl)amino]valeric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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