(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl-[(2,3-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-chloro-7-(methylthio)-3-quinolinyl]methyl-[(2,3-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl-[(2,3-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [2-chloro-7-(methylthio)-3-quinolyl]methyl-methyl-o-veratryl-ammonium Formula: C21H24ClN2O2S+ MolecularWeight: 403.94546

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C21H23ClN2O2S/c1-24(12-15-6-5-7-19(25-2)20(15)26-3)13-16-10-14-8-9-17(27-4)11-18(14)23-21(16)22/h5-11H,12-13H2,1-4H3/p+1