1-(4-chlorophenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-(2-methyl-4-quinolin-1-iumyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone Formula: C22H24ClN3O+2 MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=CC=CC=C2C(=C1)N3CC[NH+](CC3)CC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=[NH+]C2=CC=CC=C2C(=C1)N3CC[NH+](CC3)CC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O/c1-16-14-21(19-4-2-3-5-20(19)24-16)26-12-10-25(11-13-26)15-22(27)17-6-8-18(23)9-7-17/h2-9,14H,10-13,15H2,1H3/p+2