1-decyl-4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]pyridin-1-ium

Systemtic Name: 1-decyl-4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]pyridin-1-ium Openeye Name: 1-decyl-4-[(E)-2-(4-pyrrolidin-1-ylphenyl)vinyl]pyridin-1-ium CAS Name: 1-decyl-4-[(E)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]pyridin-1-ium IUPAC Name: 1-decyl-4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]pyridin-1-ium Traditional Name: 1-decyl-4-[(E)-2-(4-pyrrolidinophenyl)vinyl]pyridin-1-ium Formula: C27H39N2+ MolecularWeight: 391.61196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=C(C=C1)C=CC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C27H39N2/c1-2-3-4-5-6-7-8-9-20-28-23-18-26(19-24-28)13-12-25-14-16-27(17-15-25)29-21-10-11-22-29/h12-19,23-24H,2-11,20-22H2,1H3/q+1