azanium 6-(5-hexyl-2-methyl-phenyl)hexanoate

Systemtic Name: azanium 6-(5-hexyl-2-methyl-phenyl)hexanoate Openeye Name: ammonium 6-(5-hexyl-2-methyl-phenyl)hexanoate CAS Name: ammonium 6-(5-hexyl-2-methylphenyl)hexanoate IUPAC Name: azanium 6-(5-hexyl-2-methylphenyl)hexanoate Traditional Name: ammonium 6-(5-hexyl-2-methyl-phenyl)hexanoate Formula: C19H33NO2 MolecularWeight: 307.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)C)CCCCCC(=O)[O-].[NH4+]

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)C)CCCCCC(=O)[O-].[NH4+]

InChI

InChI=1S/C19H30O2.H3N/c1-3-4-5-7-10-17-14-13-16(2)18(15-17)11-8-6-9-12-19(20)21;/h13-15H,3-12H2,1-2H3,(H,20,21);1H3