3-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]carbonyl-1H-pyridin-2-one

Systemtic Name: 3-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]carbonyl-1H-pyridin-2-one Openeye Name: 3-[4-(8-quinolylmethyl)piperazin-4-ium-1-carbonyl]-1H-pyridin-2-one CAS Name: 3-[oxo-[4-(8-quinolinylmethyl)-1-piperazin-4-iumyl]methyl]-1H-pyridin-2-one IUPAC Name: 3-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-carbonyl]-1H-pyridin-2-one Traditional Name: 3-[4-(8-quinolylmethyl)piperazin-4-ium-1-carbonyl]-2-pyridone Formula: C20H21N4O2+ MolecularWeight: 349.40634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=C2N=CC=C3)C(=O)C4=CC=CNC4=O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=C2N=CC=C3)C(=O)C4=CC=CNC4=O

InChI

InChI=1S/C20H20N4O2/c25-19-17(7-3-9-22-19)20(26)24-12-10-23(11-13-24)14-16-5-1-4-15-6-2-8-21-18(15)16/h1-9H,10-14H2,(H,22,25)/p+1