1-methyl-2,6-bis[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]pyridin-1-ium chloride

Systemtic Name: 1-methyl-2,6-bis[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]pyridin-1-ium chloride Openeye Name: 1-methyl-2,6-bis[(E)-2-(4-pyrrolidin-1-ylphenyl)vinyl]pyridin-1-ium chloride CAS Name: 1-methyl-2,6-bis[(E)-2-[4-(1-pyrrolidinyl)phenyl]ethenyl]pyridin-1-ium chloride IUPAC Name: 1-methyl-2,6-bis[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]pyridin-1-ium chloride Traditional Name: 1-methyl-2,6-bis[(E)-2-(4-pyrrolidinophenyl)vinyl]pyridin-1-ium chloride Formula: C30H34ClN3 MolecularWeight: 472.06406

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC=C1C=CC2=CC=C(C=C2)N3CCCC3)C=CC4=CC=C(C=C4)N5CCCC5.[Cl-]

Isomeric SMILES

C[N+]1=C(C=CC=C1/C=C/C2=CC=C(C=C2)N3CCCC3)/C=C/C4=CC=C(C=C4)N5CCCC5.[Cl-]

InChI

InChI=1S/C30H34N3.ClH/c1-31-27(15-9-25-11-17-29(18-12-25)32-21-2-3-22-32)7-6-8-28(31)16-10-26-13-19-30(20-14-26)33-23-4-5-24-33;/h6-20H,2-5,21-24H2,1H3;1H/q+1;/p-1