5-chloranyl-4-[[3-(4-methoxyphenyl)-3-oxidanyl-propyl]-(phenylmethyl)amino]-2-methyl-pyridazin-3-one

Systemtic Name: 5-chloranyl-4-[[3-(4-methoxyphenyl)-3-oxidanyl-propyl]-(phenylmethyl)amino]-2-methyl-pyridazin-3-one Openeye Name: 4-[benzyl-[3-hydroxy-3-(4-methoxyphenyl)propyl]amino]-5-chloro-2-methyl-pyridazin-3-one CAS Name: 5-chloro-4-[[3-hydroxy-3-(4-methoxyphenyl)propyl]-(phenylmethyl)amino]-2-methyl-3-pyridazinone IUPAC Name: 4-[benzyl-[3-hydroxy-3-(4-methoxyphenyl)propyl]amino]-5-chloro-2-methylpyridazin-3-one Traditional Name: 4-[benzyl-[3-hydroxy-3-(4-methoxyphenyl)propyl]amino]-5-chloro-2-methyl-pyridazin-3-one Formula: C22H24ClN3O3 MolecularWeight: 413.89726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C=N1)Cl)N(CCC(C2=CC=C(C=C2)OC)O)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(C=N1)Cl)N(CCC(C2=CC=C(C=C2)OC)O)CC3=CC=CC=C3

InChI

InChI=1S/C22H24ClN3O3/c1-25-22(28)21(19(23)14-24-25)26(15-16-6-4-3-5-7-16)13-12-20(27)17-8-10-18(29-2)11-9-17/h3-11,14,20,27H,12-13,15H2,1-2H3