3-(4-butylphenyl)propyl-dimethyl-(3-sulfopropyl)azanium

Systemtic Name: 3-(4-butylphenyl)propyl-dimethyl-(3-sulfopropyl)azanium Openeye Name: 3-(4-butylphenyl)propyl-dimethyl-(3-sulfopropyl)ammonium CAS Name: 3-(4-butylphenyl)propyl-dimethyl-(3-sulfopropyl)ammonium IUPAC Name: 3-(4-butylphenyl)propyl-dimethyl-(3-sulfopropyl)azanium Traditional Name: 3-(4-butylphenyl)propyl-dimethyl-(3-sulfopropyl)ammonium Formula: C18H32NO3S+ MolecularWeight: 342.51658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CCC[N+](C)(C)CCCS(=O)(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)CCC[N+](C)(C)CCCS(=O)(=O)O

InChI

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