dimethyl-octyl-(1-phenyl-1-sulfo-ethyl)azanium

Systemtic Name: dimethyl-octyl-(1-phenyl-1-sulfo-ethyl)azanium Openeye Name: dimethyl-octyl-(1-phenyl-1-sulfo-ethyl)ammonium CAS Name: dimethyl-octyl-(1-phenyl-1-sulfoethyl)ammonium IUPAC Name: dimethyl-octyl-(1-phenyl-1-sulfoethyl)azanium Traditional Name: dimethyl-octyl-(1-phenyl-1-sulfo-ethyl)ammonium Formula: C18H32NO3S+ MolecularWeight: 342.51658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(C)C(C)(C1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC[N+](C)(C)C(C)(C1=CC=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C18H31NO3S/c1-5-6-7-8-9-13-16-19(3,4)18(2,23(20,21)22)17-14-11-10-12-15-17/h10-12,14-15H,5-9,13,16H2,1-4H3/p+1