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dodecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-4-carboxylate

dodecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-4-carboxylate

Systemtic Name:dodecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-4-carboxylate
Openeye Name:dodecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-4-carboxylate
CAS Name:1-[(Z)-octadec-9-enyl]-4-pyridin-1-iumcarboxylic acid dodecyl ester
IUPAC Name:dodecyl 1-[(Z)-octadec-9-enyl]pyridin-1-ium-4-carboxylate
Traditional Name:1-[(Z)-octadec-9-enyl]pyridin-1-ium-4-carboxylic acid lauryl ester
Formula: C36H64NO2+
MolecularWeight: 542.89886
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC=[N+](C=C1)CCCCCCCCC=CCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC=[N+](C=C1)CCCCCCCC/C=C\CCCCCCCC


InChI

InChI=1S/C36H64NO2/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-31-37-32-29-35(30-33-37)36(38)39-34-28-26-24-22-14-12-10-8-6-4-2/h16-17,29-30,32-33H,3-15,18-28,31,34H2,1-2H3/q+1/b17-16-


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