3-[[4-(ethylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one

Systemtic Name: 3-[[4-(ethylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one Openeye Name: 3-[[4-(ethylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one CAS Name: 3-[[4-(ethylamino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one IUPAC Name: 3-[[4-(ethylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one Traditional Name: 3-[[4-(ethylamino)-6-pyrrolidino-s-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one Formula: C14H20N7O2+ MolecularWeight: 318.3543

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)N2CCCC2)OC3C=CC(=O)[N+](=N3)C

Isomeric SMILES

CCNC1=NC(=NC(=N1)N2CCCC2)OC3C=CC(=O)[N+](=N3)C

InChI

InChI=1S/C14H20N7O2/c1-3-15-12-16-13(21-8-4-5-9-21)18-14(17-12)23-10-6-7-11(22)20(2)19-10/h6-7,10H,3-5,8-9H2,1-2H3,(H,15,16,17,18)/q+1