methyl 2-[5-chloranyl-6-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]pyridazin-1-yl]ethanoate

Systemtic Name: methyl 2-[5-chloranyl-6-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[4-(4-benzyl-1-piperidyl)-5-chloro-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[5-chloro-6-oxo-4-[4-(phenylmethyl)-1-piperidinyl]-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-benzylpiperidin-1-yl)-5-chloro-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[4-(4-benzylpiperidino)-5-chloro-6-keto-pyridazin-1-yl]acetic acid methyl ester Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C(=C(C=N1)N2CCC(CC2)CC3=CC=CC=C3)Cl

Isomeric SMILES

COC(=O)CN1C(=O)C(=C(C=N1)N2CCC(CC2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H22ClN3O3/c1-26-17(24)13-23-19(25)18(20)16(12-21-23)22-9-7-15(8-10-22)11-14-5-3-2-4-6-14/h2-6,12,15H,7-11,13H2,1H3