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

Systemtic Name: 3-[[4-(butan-2-ylamino)-6-methoxy-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one Openeye Name: 3-[[4-methoxy-6-(sec-butylamino)-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one CAS Name: 3-[[4-(butan-2-ylamino)-6-methoxy-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one IUPAC Name: 3-[[4-(butan-2-ylamino)-6-methoxy-1,3,5-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one Traditional Name: 3-[[4-methoxy-6-(sec-butylamino)-s-triazin-2-yl]oxy]-1-methyl-3H-pyridazin-1-ium-6-one Formula: C13H19N6O3+ MolecularWeight: 307.32836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC(=NC(=N1)OC)OC2C=CC(=O)[N+](=N2)C

Isomeric SMILES

CCC(C)NC1=NC(=NC(=N1)OC)OC2C=CC(=O)[N+](=N2)C

InChI

InChI=1S/C13H19N6O3/c1-5-8(2)14-11-15-12(21-4)17-13(16-11)22-9-6-7-10(20)19(3)18-9/h6-9H,5H2,1-4H3,(H,14,15,16,17)/q+1