6,6-dimethyl-4-oxidanylidene-3-(2-phenylcyclopropyl)-1-(4-propan-2-ylphenyl)-5,7-dihydroindazole-7-carbonitrile

Systemtic Name: 6,6-dimethyl-4-oxidanylidene-3-(2-phenylcyclopropyl)-1-(4-propan-2-ylphenyl)-5,7-dihydroindazole-7-carbonitrile Openeye Name: 1-(4-isopropylphenyl)-6,6-dimethyl-4-oxo-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile CAS Name: 6,6-dimethyl-4-oxo-3-(2-phenylcyclopropyl)-1-(4-propan-2-ylphenyl)-5,7-dihydroindazole-7-carbonitrile IUPAC Name: 6,6-dimethyl-4-oxo-3-(2-phenylcyclopropyl)-1-(4-propan-2-ylphenyl)-5,7-dihydroindazole-7-carbonitrile Traditional Name: 4-keto-6,6-dimethyl-1-p-cumenyl-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile Formula: C28H29N3O MolecularWeight: 423.54936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)CC(C3C#N)(C)C)C(=N2)C4CC4C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)CC(C3C#N)(C)C)C(=N2)C4CC4C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O/c1-17(2)18-10-12-20(13-11-18)31-27-23(16-29)28(3,4)15-24(32)25(27)26(30-31)22-14-21(22)19-8-6-5-7-9-19/h5-13,17,21-23H,14-15H2,1-4H3