(4-chlorophenyl)methyl-[2-(dodecylamino)-2-oxidanylidene-ethyl]-dimethyl-azanium

Systemtic Name: (4-chlorophenyl)methyl-[2-(dodecylamino)-2-oxidanylidene-ethyl]-dimethyl-azanium Openeye Name: (4-chlorophenyl)methyl-[2-(dodecylamino)-2-oxo-ethyl]-dimethyl-ammonium CAS Name: (4-chlorophenyl)methyl-[2-(dodecylamino)-2-oxoethyl]-dimethylammonium IUPAC Name: (4-chlorophenyl)methyl-[2-(dodecylamino)-2-oxoethyl]-dimethylazanium Traditional Name: (4-chlorobenzyl)-[2-keto-2-(laurylamino)ethyl]-dimethyl-ammonium Formula: C23H40ClN2O+ MolecularWeight: 396.0295

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C[N+](C)(C)CC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCCCCCCCCNC(=O)C[N+](C)(C)CC1=CC=C(C=C1)Cl

InChI

InChI=1S/C23H39ClN2O/c1-4-5-6-7-8-9-10-11-12-13-18-25-23(27)20-26(2,3)19-21-14-16-22(24)17-15-21/h14-17H,4-13,18-20H2,1-3H3/p+1