N-[4-[2-(1-dodecylpyridin-1-ium-4-yl)ethylsulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(1-dodecylpyridin-1-ium-4-yl)ethylsulfonyl]phenyl]ethanamide Openeye Name: N-[4-[2-(1-dodecylpyridin-1-ium-4-yl)ethylsulfonyl]phenyl]acetamide CAS Name: N-[4-[2-(1-dodecyl-4-pyridin-1-iumyl)ethylsulfonyl]phenyl]acetamide IUPAC Name: N-[4-[2-(1-dodecylpyridin-1-ium-4-yl)ethylsulfonyl]phenyl]acetamide Traditional Name: N-[4-[2-(1-laurylpyridin-1-ium-4-yl)ethylsulfonyl]phenyl]acetamide Formula: C27H41N2O3S+ MolecularWeight: 473.69104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=C(C=C1)CCS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=C(C=C1)CCS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C27H40N2O3S/c1-3-4-5-6-7-8-9-10-11-12-20-29-21-17-25(18-22-29)19-23-33(31,32)27-15-13-26(14-16-27)28-24(2)30/h13-18,21-22H,3-12,19-20,23H2,1-2H3/p+1