2-(3,4-dimethoxyphenyl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(3,4-dimethoxyphenyl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(3,4-dimethoxyphenyl)-1-[4-(4-methyl-2-quinolin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,4-dimethoxyphenyl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(3,4-dimethoxyphenyl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazino]ethanone Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H27N3O3/c1-17-14-23(25-20-7-5-4-6-19(17)20)26-10-12-27(13-11-26)24(28)16-18-8-9-21(29-2)22(15-18)30-3/h4-9,14-15H,10-13,16H2,1-3H3/p+1