(4E)-1-methyl-4-[(Z)-3-[1-methyl-2-(1-methyl-3-octyl-benzimidazol-1-ium-2-yl)pyridin-1-ium-4-yl]prop-2-enylidene]quinoline

Systemtic Name: (4E)-1-methyl-4-[(Z)-3-[1-methyl-2-(1-methyl-3-octyl-benzimidazol-1-ium-2-yl)pyridin-1-ium-4-yl]prop-2-enylidene]quinoline Openeye Name: (4E)-1-methyl-4-[(Z)-3-[1-methyl-2-(1-methyl-3-octyl-benzimidazol-1-ium-2-yl)pyridin-1-ium-4-yl]prop-2-enylidene]quinoline CAS Name: (4E)-1-methyl-4-[(Z)-3-[1-methyl-2-(1-methyl-3-octyl-2-benzimidazol-1-iumyl)-4-pyridin-1-iumyl]prop-2-enylidene]quinoline IUPAC Name: (4E)-1-methyl-4-[(Z)-3-[1-methyl-2-(1-methyl-3-octylbenzimidazol-1-ium-2-yl)pyridin-1-ium-4-yl]prop-2-enylidene]quinoline Traditional Name: (4E)-1-methyl-4-[(Z)-3-[1-methyl-2-(1-methyl-3-octyl-benzimidazol-1-ium-2-yl)pyridin-1-ium-4-yl]prop-2-enylidene]quinoline Formula: C35H42N4+2 MolecularWeight: 518.73478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2[N+](=C1C3=[N+](C=CC(=C3)C=CC=C4C=CN(C5=CC=CC=C45)C)C)C

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2[N+](=C1C3=[N+](C=CC(=C3)/C=C\C=C\4/C=CN(C5=CC=CC=C45)C)C)C

InChI

InChI=1S/C35H42N4/c1-5-6-7-8-9-14-24-39-33-21-13-12-20-32(33)38(4)35(39)34-27-28(22-25-37(34)3)16-15-17-29-23-26-36(2)31-19-11-10-18-30(29)31/h10-13,15-23,25-27H,5-9,14,24H2,1-4H3/q+2