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4-[dimethyl(9-phenylnonyl)azaniumyl]butane-1-sulfonate

4-[dimethyl(9-phenylnonyl)azaniumyl]butane-1-sulfonate

Systemtic Name:4-[dimethyl(9-phenylnonyl)azaniumyl]butane-1-sulfonate
Openeye Name:4-[dimethyl(9-phenylnonyl)ammonio]butane-1-sulfonate
CAS Name:4-[dimethyl(9-phenylnonyl)ammonio]-1-butanesulfonate
IUPAC Name:4-[dimethyl(9-phenylnonyl)azaniumyl]butane-1-sulfonate
Traditional Name:4-[dimethyl(9-phenylnonyl)ammonio]butane-1-sulfonate
Formula: C21H37NO3S
MolecularWeight: 383.58838
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCCCCCCCC1=CC=CC=C1)CCCCS(=O)(=O)[O-]


Isomeric SMILES

C[N+](C)(CCCCCCCCCC1=CC=CC=C1)CCCCS(=O)(=O)[O-]


InChI

InChI=1S/C21H37NO3S/c1-22(2,19-13-14-20-26(23,24)25)18-12-7-5-3-4-6-9-15-21-16-10-8-11-17-21/h8,10-11,16-17H,3-7,9,12-15,18-20H2,1-2H3


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