2-(4-chloranylphenoxy)-2-methyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-1-one Openeye Name: 2-(4-chlorophenoxy)-2-methyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-1-one CAS Name: 2-(4-chlorophenoxy)-2-methyl-1-[4-(4-pyridin-1-iumyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-1-one Traditional Name: 2-(4-chlorophenoxy)-2-methyl-1-(4-pyridin-1-ium-4-ylpiperazino)propan-1-one Formula: C19H23ClN3O2+ MolecularWeight: 360.85782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=CC=[NH+]C=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=CC=[NH+]C=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O2/c1-19(2,25-17-5-3-15(20)4-6-17)18(24)23-13-11-22(12-14-23)16-7-9-21-10-8-16/h3-10H,11-14H2,1-2H3/p+1