methyl 2-[5-chloranyl-4-(3,5-dimethylpiperidin-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoate

Systemtic Name: methyl 2-[5-chloranyl-4-(3,5-dimethylpiperidin-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[5-chloro-4-(3,5-dimethyl-1-piperidyl)-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[5-chloro-4-(3,5-dimethyl-1-piperidinyl)-6-oxo-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-chloro-4-(3,5-dimethylpiperidin-1-yl)-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[5-chloro-4-(3,5-dimethylpiperidino)-6-keto-pyridazin-1-yl]acetic acid methyl ester Formula: C14H20ClN3O3 MolecularWeight: 313.7799

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C(=O)N(N=C2)CC(=O)OC)Cl)C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C(=O)N(N=C2)CC(=O)OC)Cl)C

InChI

InChI=1S/C14H20ClN3O3/c1-9-4-10(2)7-17(6-9)11-5-16-18(8-12(19)21-3)14(20)13(11)15/h5,9-10H,4,6-8H2,1-3H3