3-[4-[(E)-2-[6-(dioctylamino)naphthalen-2-yl]ethenyl]pyridin-1-ium-1-yl]propyl-trimethyl-azanium

Systemtic Name: 3-[4-[(E)-2-[6-(dioctylamino)naphthalen-2-yl]ethenyl]pyridin-1-ium-1-yl]propyl-trimethyl-azanium Openeye Name: 3-[4-[(E)-2-[6-(dioctylamino)-2-naphthyl]vinyl]pyridin-1-ium-1-yl]propyl-trimethyl-ammonium CAS Name: 3-[4-[(E)-2-[6-(dioctylamino)-2-naphthalenyl]ethenyl]-1-pyridin-1-iumyl]propyl-trimethylammonium IUPAC Name: 3-[4-[(E)-2-[6-(dioctylamino)naphthalen-2-yl]ethenyl]pyridin-1-ium-1-yl]propyl-trimethylazanium Traditional Name: 3-[4-[(E)-2-[6-(dioctylamino)-2-naphthyl]vinyl]pyridin-1-ium-1-yl]propyl-trimethyl-ammonium Formula: C39H61N3+2 MolecularWeight: 571.92174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)C1=CC2=C(C=C1)C=C(C=C2)C=CC3=CC=[N+](C=C3)CCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)C1=CC2=C(C=C1)C=C(C=C2)/C=C/C3=CC=[N+](C=C3)CCC[N+](C)(C)C

InChI

InChI=1S/C39H61N3/c1-6-8-10-12-14-16-28-41(29-17-15-13-11-9-7-2)39-24-23-37-33-36(21-22-38(37)34-39)20-19-35-25-30-40(31-26-35)27-18-32-42(3,4)5/h19-26,30-31,33-34H,6-18,27-29,32H2,1-5H3/q+2