1-[(4-heptadecylphenyl)methyl]pyridin-1-ium

Systemtic Name: 1-[(4-heptadecylphenyl)methyl]pyridin-1-ium Openeye Name: 1-[(4-heptadecylphenyl)methyl]pyridin-1-ium CAS Name: 1-[(4-heptadecylphenyl)methyl]pyridin-1-ium IUPAC Name: 1-[(4-heptadecylphenyl)methyl]pyridin-1-ium Traditional Name: 1-(4-heptadecylbenzyl)pyridin-1-ium Formula: C29H46N+ MolecularWeight: 408.68224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C[N+]2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=CC=C(C=C1)C[N+]2=CC=CC=C2

InChI

InChI=1S/C29H46N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-28-21-23-29(24-22-28)27-30-25-18-16-19-26-30/h16,18-19,21-26H,2-15,17,20,27H2,1H3/q+1