4,5-bis(chloranyl)-2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-oxo-ethyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[2-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-oxoethyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[2-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-oxoethyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[2-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-keto-ethyl]pyridazin-3-one Formula: C20H19Cl2N3O2 MolecularWeight: 404.28976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3C(=O)C(=C(C=N3)Cl)Cl

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3C(=O)C(=C(C=N3)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3O2/c1-13-10-16(14(2)24(13)9-8-15-6-4-3-5-7-15)18(26)12-25-20(27)19(22)17(21)11-23-25/h3-7,10-11H,8-9,12H2,1-2H3