(hexanoylamino)-methyl-phenyl-azanium chloride

Systemtic Name: (hexanoylamino)-methyl-phenyl-azanium chloride Openeye Name: (hexanoylamino)-methyl-phenyl-ammonium chloride CAS Name: methyl-(1-oxohexylamino)-phenylammonium chloride IUPAC Name: (hexanoylamino)-methyl-phenylazanium chloride Traditional Name: (caproylamino)-methyl-phenyl-ammonium chloride Formula: C13H21ClN2O MolecularWeight: 256.77164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N[NH+](C)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCC(=O)N[NH+](C)C1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C13H20N2O.ClH/c1-3-4-6-11-13(16)14-15(2)12-9-7-5-8-10-12;/h5,7-10H,3-4,6,11H2,1-2H3,(H,14,16);1H