2-methyl-5-[4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one

Systemtic Name: 2-methyl-5-[4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one Openeye Name: 2-methyl-5-[4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one CAS Name: 2-methyl-5-[4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-1-piperazin-4-iumyl]-3-pyridazinone IUPAC Name: 2-methyl-5-[4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one Traditional Name: 2-methyl-5-[4-[(1-methyl-3,4-dihydro-2H-quinolin-6-yl)methyl]piperazin-4-ium-1-yl]pyridazin-3-one Formula: C20H28N5O+ MolecularWeight: 354.46922

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC2=C1C=CC(=C2)C[NH+]3CCN(CC3)C4=CC(=O)N(N=C4)C

Isomeric SMILES

CN1CCCC2=C1C=CC(=C2)C[NH+]3CCN(CC3)C4=CC(=O)N(N=C4)C

InChI

InChI=1S/C20H27N5O/c1-22-7-3-4-17-12-16(5-6-19(17)22)15-24-8-10-25(11-9-24)18-13-20(26)23(2)21-14-18/h5-6,12-14H,3-4,7-11,15H2,1-2H3/p+1