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

Systemtic Name: 5-[4-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one Openeye Name: 5-[4-[(6-methoxyindan-5-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one CAS Name: 5-[4-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]-1-piperazin-4-iumyl]-2-methyl-3-pyridazinone IUPAC Name: 5-[4-[(6-methoxy-2,3-dihydro-1H-inden-5-yl)methyl]piperazin-4-ium-1-yl]-2-methylpyridazin-3-one Traditional Name: 5-[4-[(6-methoxyindan-5-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(C=N1)N2CC[NH+](CC2)CC3=C(C=C4CCCC4=C3)OC

Isomeric SMILES

CN1C(=O)C=C(C=N1)N2CC[NH+](CC2)CC3=C(C=C4CCCC4=C3)OC

InChI

InChI=1S/C20H26N4O2/c1-22-20(25)12-18(13-21-22)24-8-6-23(7-9-24)14-17-10-15-4-3-5-16(15)11-19(17)26-2/h10-13H,3-9,14H2,1-2H3/p+1