1-(6-chloranylpyridazin-3-yl)-7,7-dimethyl-3-(2-phenylcyclopropyl)-5,6-dihydroindazol-4-one

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-7,7-dimethyl-3-(2-phenylcyclopropyl)-5,6-dihydroindazol-4-one Openeye Name: 1-(6-chloropyridazin-3-yl)-7,7-dimethyl-3-(2-phenylcyclopropyl)-5,6-dihydroindazol-4-one CAS Name: 1-(6-chloro-3-pyridazinyl)-7,7-dimethyl-3-(2-phenylcyclopropyl)-5,6-dihydroindazol-4-one IUPAC Name: 1-(6-chloropyridazin-3-yl)-7,7-dimethyl-3-(2-phenylcyclopropyl)-5,6-dihydroindazol-4-one Traditional Name: 1-(6-chloropyridazin-3-yl)-7,7-dimethyl-3-(2-phenylcyclopropyl)-5,6-dihydroindazol-4-one Formula: C22H21ClN4O MolecularWeight: 392.88134

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C2=C1N(N=C2C3CC3C4=CC=CC=C4)C5=NN=C(C=C5)Cl)C

Isomeric SMILES

CC1(CCC(=O)C2=C1N(N=C2C3CC3C4=CC=CC=C4)C5=NN=C(C=C5)Cl)C

InChI

InChI=1S/C22H21ClN4O/c1-22(2)11-10-16(28)19-20(15-12-14(15)13-6-4-3-5-7-13)26-27(21(19)22)18-9-8-17(23)24-25-18/h3-9,14-15H,10-12H2,1-2H3