4-dodecylbenzoate; ethyl-dimethyl-tetradecyl-azanium

Systemtic Name: 4-dodecylbenzoate; ethyl-dimethyl-tetradecyl-azanium Openeye Name: 4-dodecylbenzoate; ethyl-dimethyl-tetradecyl-ammonium CAS Name: 4-dodecylbenzoate; ethyl-dimethyl-tetradecylammonium IUPAC Name: 4-dodecylbenzoate; ethyl-dimethyl-tetradecylazanium Traditional Name: ethyl-dimethyl-myristyl-ammonium; 4-laurylbenzoate Formula: C37H69NO2 MolecularWeight: 559.94926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](C)(C)CC.CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCC[N+](C)(C)CC.CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C19H30O2.C18H40N/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)19(20)21;1-5-7-8-9-10-11-12-13-14-15-16-17-18-19(3,4)6-2/h13-16H,2-12H2,1H3,(H,20,21);5-18H2,1-4H3/q;+1/p-1