3-[3-[4-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]piperidin-1-yl]-3-oxidanylidene-propyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3-[4-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]piperidin-1-yl]-3-oxidanylidene-propyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[3-[4-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxo-propyl]-1-piperidyl]-3-oxo-propyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[3-[4-[3-(4-ethyl-1-piperazin-4-iumyl)-3-oxopropyl]-1-piperidinyl]-3-oxopropyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[3-[4-[3-(4-ethylpiperazin-4-ium-1-yl)-3-oxopropyl]piperidin-1-yl]-3-oxopropyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[3-[4-[3-(4-ethylpiperazin-4-ium-1-yl)-3-keto-propyl]piperidino]-3-keto-propyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C21H36N5O3+ MolecularWeight: 406.54224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)CCC3=NNC(=O)CC3

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)CCC3=NNC(=O)CC3

InChI

InChI=1S/C21H35N5O3/c1-2-24-13-15-26(16-14-24)20(28)7-3-17-9-11-25(12-10-17)21(29)8-5-18-4-6-19(27)23-22-18/h17H,2-16H2,1H3,(H,23,27)/p+1