3-chloranyl-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-(phenylmethyl)pyridin-2-one

Systemtic Name: 3-chloranyl-5-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-(phenylmethyl)pyridin-2-one Openeye Name: 1-benzyl-3-chloro-5-(4-methylpiperazin-4-ium-1-carbonyl)pyridin-2-one CAS Name: 3-chloro-5-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-(phenylmethyl)-2-pyridinone IUPAC Name: 1-benzyl-3-chloro-5-(4-methylpiperazin-4-ium-1-carbonyl)pyridin-2-one Traditional Name: 1-benzyl-3-chloro-5-(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=CN(C(=O)C(=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

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

InChI

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