2-chloranyl-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]quinoline

Systemtic Name: 2-chloranyl-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]quinoline Openeye Name: 2-chloro-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]quinoline CAS Name: 2-chloro-3-[[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]methyl]quinoline IUPAC Name: 2-chloro-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]quinoline Traditional Name: 2-chloro-3-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]quinoline Formula: C22H25ClN3+ MolecularWeight: 366.907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CC4=CC=CC=C4N=C3Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CC4=CC=CC=C4N=C3Cl)C

InChI

InChI=1S/C22H24ClN3/c1-16-6-5-9-21(17(16)2)26-12-10-25(11-13-26)15-19-14-18-7-3-4-8-20(18)24-22(19)23/h3-9,14H,10-13,15H2,1-2H3/p+1