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

Systemtic Name: ethyl 2-[5-chloranyl-6-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]pyridazin-1-yl]ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H24ClN3O3 MolecularWeight: 389.87586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O3/c1-2-27-18(25)14-24-20(26)19(21)17(13-22-24)23-10-8-16(9-11-23)12-15-6-4-3-5-7-15/h3-7,13,16H,2,8-12,14H2,1H3