azanium 2-(4,6,8,10,12,14,16-heptamethylheptadecan-2-yl)benzenesulfonate

Systemtic Name: azanium 2-(4,6,8,10,12,14,16-heptamethylheptadecan-2-yl)benzenesulfonate Openeye Name: ammonium 2-(1,3,5,7,9,11,13,15-octamethylhexadecyl)benzenesulfonate CAS Name: ammonium 2-(4,6,8,10,12,14,16-heptamethylheptadecan-2-yl)benzenesulfonate IUPAC Name: azanium 2-(4,6,8,10,12,14,16-heptamethylheptadecan-2-yl)benzenesulfonate Traditional Name: ammonium 2-(1,3,5,7,9,11,13,15-octamethylhexadecyl)besylate Formula: C30H57NO3S MolecularWeight: 511.84348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)C1=CC=CC=C1S(=O)(=O)[O-].[NH4+]

Isomeric SMILES

CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)C1=CC=CC=C1S(=O)(=O)[O-].[NH4+]

InChI

InChI=1S/C30H54O3S.H3N/c1-21(2)14-22(3)15-23(4)16-24(5)17-25(6)18-26(7)19-27(8)20-28(9)29-12-10-11-13-30(29)34(31,32)33;/h10-13,21-28H,14-20H2,1-9H3,(H,31,32,33);1H3