6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-olate

Systemtic Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-olate Openeye Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-olate CAS Name: 6-[[4-(1-azepanyl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]-3-pyridazinolate IUPAC Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]pyridazin-3-olate Traditional Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-s-triazin-2-yl]oxy]pyridazin-3-olate Formula: C15H20N7O2- MolecularWeight: 330.365

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N2CCCCCC2)OC3=NN=C(C=C3)[O-]

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N2CCCCCC2)OC3=NN=C(C=C3)[O-]

InChI

InChI=1S/C15H21N7O2/c1-21(2)13-16-14(22-9-5-3-4-6-10-22)18-15(17-13)24-12-8-7-11(23)19-20-12/h7-8H,3-6,9-10H2,1-2H3,(H,19,23)/p-1