butyl-(2,6-dimethylphenyl)-methanoyl-pentyl-azanium chloride

Systemtic Name: butyl-(2,6-dimethylphenyl)-methanoyl-pentyl-azanium chloride Openeye Name: butyl-(2,6-dimethylphenyl)-formyl-pentyl-ammonium chloride CAS Name: butyl-(2,6-dimethylphenyl)-formyl-pentylammonium chloride IUPAC Name: butyl-(2,6-dimethylphenyl)-formyl-pentylazanium chloride Traditional Name: amyl-butyl-(2,6-dimethylphenyl)-formyl-ammonium chloride Formula: C18H30ClNO MolecularWeight: 311.8899

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCCC)(C=O)C1=C(C=CC=C1C)C.[Cl-]

Isomeric SMILES

CCCCC[N+](CCCC)(C=O)C1=C(C=CC=C1C)C.[Cl-]

InChI

InChI=1S/C18H30NO.ClH/c1-5-7-9-14-19(15-20,13-8-6-2)18-16(3)11-10-12-17(18)4;/h10-12,15H,5-9,13-14H2,1-4H3;1H/q+1;/p-1