1-[(Z)-octadec-9-enyl]-3-pentadecyl-pyridin-1-ium chloride

Systemtic Name: 1-[(Z)-octadec-9-enyl]-3-pentadecyl-pyridin-1-ium chloride Openeye Name: 1-[(Z)-octadec-9-enyl]-3-pentadecyl-pyridin-1-ium chloride CAS Name: 1-[(Z)-octadec-9-enyl]-3-pentadecylpyridin-1-ium chloride IUPAC Name: 1-[(Z)-octadec-9-enyl]-3-pentadecylpyridin-1-ium chloride Traditional Name: 1-[(Z)-octadec-9-enyl]-3-pentadecyl-pyridin-1-ium chloride Formula: C38H70ClN MolecularWeight: 576.4221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C[N+](=CC=C1)CCCCCCCCC=CCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C[N+](=CC=C1)CCCCCCCC/C=C\CCCCCCCC.[Cl-]

InChI

InChI=1S/C38H70N.ClH/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-35-39-36-32-34-38(37-39)33-30-28-26-24-22-20-16-14-12-10-8-6-4-2;/h17-18,32,34,36-37H,3-16,19-31,33,35H2,1-2H3;1H/q+1;/p-1/b18-17-;