6-chloranyl-2-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)ethenyl]-1-methyl-quinolin-1-ium chloride

Systemtic Name: 6-chloranyl-2-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)ethenyl]-1-methyl-quinolin-1-ium chloride Openeye Name: 6-chloro-2-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)vinyl]-1-methyl-quinolin-1-ium chloride CAS Name: 6-chloro-2-[2-(2,5-dimethyl-1-phenyl-3-pyrrolyl)ethenyl]-1-methylquinolin-1-ium chloride IUPAC Name: 6-chloro-2-[2-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethenyl]-1-methylquinolin-1-ium chloride Traditional Name: 6-chloro-2-[2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)vinyl]-1-methyl-quinolin-1-ium chloride Formula: C24H22Cl2N2 MolecularWeight: 409.35088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)Cl)C.[Cl-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C=CC3=[N+](C4=C(C=C3)C=C(C=C4)Cl)C.[Cl-]

InChI

InChI=1S/C24H22ClN2.ClH/c1-17-15-19(18(2)27(17)23-7-5-4-6-8-23)9-12-22-13-10-20-16-21(25)11-14-24(20)26(22)3;/h4-16H,1-3H3;1H/q+1;/p-1