3-[3,3-dimethyl-2-(4-methylphenyl)indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3,3-dimethyl-2-(4-methylphenyl)indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[3,3-dimethyl-2-(p-tolyl)indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[3,3-dimethyl-2-(4-methylphenyl)-5-indolyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[3,3-dimethyl-2-(4-methylphenyl)indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[3,3-dimethyl-2-(p-tolyl)indol-5-yl]-4,5-dihydro-1H-pyridazin-6-one Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C2(C)C)C=C(C=C3)C4=NNC(=O)CC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C2(C)C)C=C(C=C3)C4=NNC(=O)CC4

InChI

InChI=1S/C21H21N3O/c1-13-4-6-14(7-5-13)20-21(2,3)16-12-15(8-9-18(16)22-20)17-10-11-19(25)24-23-17/h4-9,12H,10-11H2,1-3H3,(H,24,25)