3-(5-chloranyl-5-ethanoyl-2-oxidanidyl-1,6-dihydropyridazin-2-ium-2-yl)propyl ethanoate

Systemtic Name: 3-(5-chloranyl-5-ethanoyl-2-oxidanidyl-1,6-dihydropyridazin-2-ium-2-yl)propyl ethanoate Openeye Name: 3-(5-acetyl-5-chloro-2-oxido-1,6-dihydropyridazin-2-ium-2-yl)propyl acetate CAS Name: acetic acid 3-(5-acetyl-5-chloro-2-oxido-1,6-dihydropyridazin-2-ium-2-yl)propyl ester IUPAC Name: 3-(5-acetyl-5-chloro-2-oxido-1,6-dihydropyridazin-2-ium-2-yl)propyl acetate Traditional Name: acetic acid 3-(5-acetyl-5-chloro-2-oxido-1,6-dihydropyridazin-2-ium-2-yl)propyl ester Formula: C11H17ClN2O4 MolecularWeight: 276.71668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CN[N+](C=C1)(CCCOC(=O)C)[O-])Cl

Isomeric SMILES

CC(=O)C1(CN[N+](C=C1)(CCCOC(=O)C)[O-])Cl

InChI

InChI=1S/C11H17ClN2O4/c1-9(15)11(12)4-6-14(17,13-8-11)5-3-7-18-10(2)16/h4,6,13H,3,5,7-8H2,1-2H3