1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methyl-pyridin-1-ium

Systemtic Name: 1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methyl-pyridin-1-ium Openeye Name: 1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methyl-pyridin-1-ium CAS Name: 1-[5-[3,5-bis[5-(3-methyl-1-pyridin-1-iumyl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methylpyridin-1-ium IUPAC Name: 1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methylpyridin-1-ium Traditional Name: 1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methyl-pyridin-1-ium Formula: C39H42N3+3 MolecularWeight: 552.77088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)CCCC#CC2=CC(=CC(=C2)C#CCCC[N+]3=CC=CC(=C3)C)C#CCCC[N+]4=CC=CC(=C4)C

Isomeric SMILES

CC1=C[N+](=CC=C1)CCCC#CC2=CC(=CC(=C2)C#CCCC[N+]3=CC=CC(=C3)C)C#CCCC[N+]4=CC=CC(=C4)C

InChI

InChI=1S/C39H42N3/c1-34-16-13-25-40(31-34)22-10-4-7-19-37-28-38(20-8-5-11-23-41-26-14-17-35(2)32-41)30-39(29-37)21-9-6-12-24-42-27-15-18-36(3)33-42/h13-18,25-33H,4-6,10-12,22-24H2,1-3H3/q+3