1-(2-methyltridecan-2-ylazaniumyl)propane-1-sulfonate

Systemtic Name: 1-(2-methyltridecan-2-ylazaniumyl)propane-1-sulfonate Openeye Name: 1-(1,1-dimethyldodecylammonio)propane-1-sulfonate CAS Name: 1-(2-methyltridecan-2-ylammonio)-1-propanesulfonate IUPAC Name: 1-(2-methyltridecan-2-ylazaniumyl)propane-1-sulfonate Traditional Name: 1-(1,1-dimethyldodecylammonio)propane-1-sulfonate Formula: C17H37NO3S MolecularWeight: 335.54558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)(C)[NH2+]C(CC)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(C)(C)[NH2+]C(CC)S(=O)(=O)[O-]

InChI

InChI=1S/C17H37NO3S/c1-5-7-8-9-10-11-12-13-14-15-17(3,4)18-16(6-2)22(19,20)21/h16,18H,5-15H2,1-4H3,(H,19,20,21)