1-[12-(3,4-dipentylpyridin-1-ium-1-yl)dodecyl]-3,4-dipentyl-pyridin-1-ium

Systemtic Name: 1-[12-(3,4-dipentylpyridin-1-ium-1-yl)dodecyl]-3,4-dipentyl-pyridin-1-ium Openeye Name: 1-[12-(3,4-dipentylpyridin-1-ium-1-yl)dodecyl]-3,4-dipentyl-pyridin-1-ium CAS Name: 1-[12-(3,4-dipentyl-1-pyridin-1-iumyl)dodecyl]-3,4-dipentylpyridin-1-ium IUPAC Name: 1-[12-(3,4-dipentylpyridin-1-ium-1-yl)dodecyl]-3,4-dipentylpyridin-1-ium Traditional Name: 3,4-diamyl-1-[12-(3,4-diamylpyridin-1-ium-1-yl)dodecyl]pyridin-1-ium Formula: C42H74N2+2 MolecularWeight: 607.05036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=[N+](C=C1)CCCCCCCCCCCC[N+]2=CC(=C(C=C2)CCCCC)CCCCC)CCCCC

Isomeric SMILES

CCCCCC1=C(C=[N+](C=C1)CCCCCCCCCCCC[N+]2=CC(=C(C=C2)CCCCC)CCCCC)CCCCC

InChI

InChI=1S/C42H74N2/c1-5-9-21-27-39-31-35-43(37-41(39)29-23-11-7-3)33-25-19-17-15-13-14-16-18-20-26-34-44-36-32-40(28-22-10-6-2)42(38-44)30-24-12-8-4/h31-32,35-38H,5-30,33-34H2,1-4H3/q+2