1-butyl-2-[3-(1-butylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline chloride

Systemtic Name: 1-butyl-2-[3-(1-butylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline chloride Openeye Name: 1-butyl-2-[3-(1-butylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline chloride CAS Name: 1-butyl-2-[3-(1-butyl-2-quinolin-1-iumyl)prop-2-enylidene]quinoline chloride IUPAC Name: 1-butyl-2-[3-(1-butylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline chloride Traditional Name: 1-butyl-2-[3-(1-butylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline chloride Formula: C29H33ClN2 MolecularWeight: 445.03872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC=CC2=[N+](C3=CC=CC=C3C=C2)CCCC)C=CC4=CC=CC=C41.[Cl-]

Isomeric SMILES

CCCCN1C(=CC=CC2=[N+](C3=CC=CC=C3C=C2)CCCC)C=CC4=CC=CC=C41.[Cl-]

InChI

InChI=1S/C29H33N2.ClH/c1-3-5-22-30-26(20-18-24-12-7-9-16-28(24)30)14-11-15-27-21-19-25-13-8-10-17-29(25)31(27)23-6-4-2;/h7-21H,3-6,22-23H2,1-2H3;1H/q+1;/p-1