(2-carboxyphenyl)methyl-hexadecyl-dimethyl-azanium

Systemtic Name: (2-carboxyphenyl)methyl-hexadecyl-dimethyl-azanium Openeye Name: (2-carboxyphenyl)methyl-hexadecyl-dimethyl-ammonium CAS Name: (2-carboxyphenyl)methyl-hexadecyl-dimethylammonium IUPAC Name: (2-carboxyphenyl)methyl-hexadecyl-dimethylazanium Traditional Name: (2-carboxybenzyl)-cetyl-dimethyl-ammonium Formula: C26H46NO2+ MolecularWeight: 404.64894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C26H45NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-27(2,3)23-24-20-17-18-21-25(24)26(28)29/h17-18,20-21H,4-16,19,22-23H2,1-3H3/p+1