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

Systemtic Name: ethyl 2-[5-chloranyl-4-(3,5-dimethylpiperidin-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C15H22ClN3O3 MolecularWeight: 327.80648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C(=C(C=N1)N2CC(CC(C2)C)C)Cl

Isomeric SMILES

CCOC(=O)CN1C(=O)C(=C(C=N1)N2CC(CC(C2)C)C)Cl

InChI

InChI=1S/C15H22ClN3O3/c1-4-22-13(20)9-19-15(21)14(16)12(6-17-19)18-7-10(2)5-11(3)8-18/h6,10-11H,4-5,7-9H2,1-3H3