diethyl-heptyl-[(E)-1-[4-(methylsulfonylamino)phenyl]but-2-enyl]azanium

Systemtic Name: diethyl-heptyl-[(E)-1-[4-(methylsulfonylamino)phenyl]but-2-enyl]azanium Openeye Name: diethyl-heptyl-[(E)-1-[4-(methanesulfonamido)phenyl]but-2-enyl]ammonium CAS Name: diethyl-heptyl-[(E)-1-[4-(methanesulfonamido)phenyl]but-2-enyl]ammonium IUPAC Name: diethyl-heptyl-[(E)-1-[4-(methanesulfonamido)phenyl]but-2-enyl]azanium Traditional Name: diethyl-heptyl-[(E)-1-[4-(methanesulfonamido)phenyl]but-2-enyl]ammonium Formula: C22H39N2O2S+ MolecularWeight: 395.62226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](CC)(CC)C(C=CC)C1=CC=C(C=C1)NS(=O)(=O)C

Isomeric SMILES

CCCCCCC[N+](CC)(CC)C(/C=C/C)C1=CC=C(C=C1)NS(=O)(=O)C

InChI

InChI=1S/C22H39N2O2S/c1-6-10-11-12-13-19-24(8-3,9-4)22(14-7-2)20-15-17-21(18-16-20)23-27(5,25)26/h7,14-18,22-23H,6,8-13,19H2,1-5H3/q+1/b14-7+