(2,6-dimethylquinolin-3-yl)-(4-pyridin-1-ium-4-ylpiperazin-1-yl)methanone

Systemtic Name: (2,6-dimethylquinolin-3-yl)-(4-pyridin-1-ium-4-ylpiperazin-1-yl)methanone Openeye Name: (2,6-dimethyl-3-quinolyl)-(4-pyridin-1-ium-4-ylpiperazin-1-yl)methanone CAS Name: (2,6-dimethyl-3-quinolinyl)-[4-(4-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (2,6-dimethylquinolin-3-yl)-(4-pyridin-1-ium-4-ylpiperazin-1-yl)methanone Traditional Name: (2,6-dimethyl-3-quinolyl)-(4-pyridin-1-ium-4-ylpiperazino)methanone Formula: C21H23N4O+ MolecularWeight: 347.43352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)N3CCN(CC3)C4=CC=[NH+]C=C4

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)C)C(=O)N3CCN(CC3)C4=CC=[NH+]C=C4

InChI

InChI=1S/C21H22N4O/c1-15-3-4-20-17(13-15)14-19(16(2)23-20)21(26)25-11-9-24(10-12-25)18-5-7-22-8-6-18/h3-8,13-14H,9-12H2,1-2H3/p+1