4-dodecylbenzenesulfonate; (4-methoxyphenyl)methyl-dimethyl-phenyl-azanium

Systemtic Name: 4-dodecylbenzenesulfonate; (4-methoxyphenyl)methyl-dimethyl-phenyl-azanium Openeye Name: 4-dodecylbenzenesulfonate; (4-methoxyphenyl)methyl-dimethyl-phenyl-ammonium CAS Name: 4-dodecylbenzenesulfonate; (4-methoxyphenyl)methyl-dimethyl-phenylammonium IUPAC Name: 4-dodecylbenzenesulfonate; (4-methoxyphenyl)methyl-dimethyl-phenylazanium Traditional Name: dimethyl-p-anisyl-phenyl-ammonium; 4-laurylbesylate Formula: C34H49NO4S MolecularWeight: 567.82216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](C)(CC1=CC=C(C=C1)OC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](C)(CC1=CC=C(C=C1)OC)C2=CC=CC=C2

InChI

InChI=1S/C18H30O3S.C16H20NO/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;1-17(2,15-7-5-4-6-8-15)13-14-9-11-16(18-3)12-10-14/h13-16H,2-12H2,1H3,(H,19,20,21);4-12H,13H2,1-3H3/q;+1/p-1