2-[(3-chlorophenyl)-methyl-amino]ethyl-hexyl-dimethyl-azanium

Systemtic Name: 2-[(3-chlorophenyl)-methyl-amino]ethyl-hexyl-dimethyl-azanium Openeye Name: 2-(3-chloro-N-methyl-anilino)ethyl-hexyl-dimethyl-ammonium CAS Name: 2-(3-chloro-N-methylanilino)ethyl-hexyl-dimethylammonium IUPAC Name: 2-(3-chloro-N-methylanilino)ethyl-hexyl-dimethylazanium Traditional Name: 2-(3-chloro-N-methyl-anilino)ethyl-hexyl-dimethyl-ammonium Formula: C17H30ClN2+ MolecularWeight: 297.8865

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](C)(C)CCN(C)C1=CC(=CC=C1)Cl

Isomeric SMILES

CCCCCC[N+](C)(C)CCN(C)C1=CC(=CC=C1)Cl

InChI

InChI=1S/C17H30ClN2/c1-5-6-7-8-13-20(3,4)14-12-19(2)17-11-9-10-16(18)15-17/h9-11,15H,5-8,12-14H2,1-4H3/q+1