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

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-chlorophenoxy)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(4-chlorophenoxy)-1-[4-(4-methyl-2-quinolin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-chlorophenoxy)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazino]ethanone Formula: C22H23ClN3O2+ MolecularWeight: 396.88992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)COC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2/c1-16-14-21(24-20-5-3-2-4-19(16)20)25-10-12-26(13-11-25)22(27)15-28-18-8-6-17(23)7-9-18/h2-9,14H,10-13,15H2,1H3/p+1