2-(3-methoxyphenyl)-6-(2-oxidanylidenepropyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-one

Systemtic Name: 2-(3-methoxyphenyl)-6-(2-oxidanylidenepropyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-one Openeye Name: 6-acetonyl-2-(3-methoxyphenyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-one CAS Name: 2-(3-methoxyphenyl)-6-(2-oxopropyl)-3,4-diphenyl-7-pyrazolo[3,4-d]pyridazinone IUPAC Name: 2-(3-methoxyphenyl)-6-(2-oxopropyl)-3,4-diphenylpyrazolo[3,4-d]pyridazin-7-one Traditional Name: 6-acetonyl-2-(3-methoxyphenyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-one Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=O)C2=NN(C(=C2C(=N1)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)OC

Isomeric SMILES

CC(=O)CN1C(=O)C2=NN(C(=C2C(=N1)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)OC

InChI

InChI=1S/C27H22N4O3/c1-18(32)17-30-27(33)25-23(24(28-30)19-10-5-3-6-11-19)26(20-12-7-4-8-13-20)31(29-25)21-14-9-15-22(16-21)34-2/h3-16H,17H2,1-2H3