1-[(3-chlorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyridin-2-one

Systemtic Name: 1-[(3-chlorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyridin-2-one Openeye Name: 1-[(3-chlorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-carbonyl)pyridin-2-one CAS Name: 1-[(3-chlorophenyl)methyl]-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-2-pyridinone IUPAC Name: 1-[(3-chlorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-carbonyl)pyridin-2-one Traditional Name: 1-(3-chlorobenzyl)-3-(4-methylpiperazin-4-ium-1-carbonyl)-2-pyridone Formula: C18H21ClN3O2+ MolecularWeight: 346.83124

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=CN(C2=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=CN(C2=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H20ClN3O2/c1-20-8-10-21(11-9-20)17(23)16-6-3-7-22(18(16)24)13-14-4-2-5-15(19)12-14/h2-7,12H,8-11,13H2,1H3/p+1