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1-[(9E,28E)-heptatriaconta-9,28-dien-19-yl]pyridin-1-ium

1-[(9E,28E)-heptatriaconta-9,28-dien-19-yl]pyridin-1-ium

Systemtic Name:1-[(9E,28E)-heptatriaconta-9,28-dien-19-yl]pyridin-1-ium
Openeye Name:1-[(E)-1-[(E)-octadec-9-enyl]nonadec-10-enyl]pyridin-1-ium
CAS Name:1-[(9E,28E)-heptatriaconta-9,28-dien-19-yl]pyridin-1-ium
IUPAC Name:1-[(9E,28E)-heptatriaconta-9,28-dien-19-yl]pyridin-1-ium
Traditional Name:1-[(E)-1-[(E)-octadec-9-enyl]nonadec-10-enyl]pyridin-1-ium
Formula: C42H76N+
MolecularWeight: 595.05954
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC(CCCCCCCCC=CCCCCCCCC)[N+]1=CC=CC=C1


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC([N+]1=CC=CC=C1)CCCCCCCC/C=C/CCCCCCCC


InChI

InChI=1S/C42H76N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-38-42(43-40-36-33-37-41-43)39-35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,33,36-37,40-42H,3-16,21-32,34-35,38-39H2,1-2H3/q+1/b19-17+,20-18+


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