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

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

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

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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