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

Systemtic Name: tetradecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-3-carboxylate chloride Openeye Name: tetradecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-3-carboxylate chloride CAS Name: 1-[(Z)-octadec-9-enyl]-3-pyridin-1-iumcarboxylic acid tetradecyl ester chloride IUPAC Name: tetradecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-3-carboxylate chloride Traditional Name: 1-[(Z)-octadec-9-enyl]pyridin-1-ium-3-carboxylic acid myristyl ester chloride Formula: C38H68ClNO2 MolecularWeight: 606.40502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H68NO2.ClH/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-33-39-34-31-32-37(36-39)38(40)41-35-30-28-26-24-22-16-14-12-10-8-6-4-2;/h17-18,31-32,34,36H,3-16,19-30,33,35H2,1-2H3;1H/q+1;/p-1/b18-17-;