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

Systemtic Name: 1-(4-methoxyphenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[4-(2-methyl-4-quinolin-1-iumyl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[4-(2-methylquinolin-1-ium-4-yl)piperazin-1-ium-1-yl]ethanone Formula: C23H27N3O2+2 MolecularWeight: 377.47938

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O2/c1-17-15-22(20-5-3-4-6-21(20)24-17)26-13-11-25(12-14-26)16-23(27)18-7-9-19(28-2)10-8-18/h3-10,15H,11-14,16H2,1-2H3/p+2