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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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