N-(2,3-dimethyl-6-nitro-phenyl)pentanamide

Systemtic Name: N-(2,3-dimethyl-6-nitro-phenyl)pentanamide Openeye Name: N-(2,3-dimethyl-6-nitro-phenyl)pentanamide CAS Name: N-(2,3-dimethyl-6-nitrophenyl)pentanamide IUPAC Name: N-(2,3-dimethyl-6-nitrophenyl)pentanamide Traditional Name: N-(2,3-dimethyl-6-nitro-phenyl)valeramide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=CC(=C1C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C=CC(=C1C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O3/c1-4-5-6-12(16)14-13-10(3)9(2)7-8-11(13)15(17)18/h7-8H,4-6H2,1-3H3,(H,14,16)