3-(4-butylphenyl)-5-(2-oxidanylidenepropyl)-1H-indeno[1,2-c]pyrazol-4-one

Systemtic Name: 3-(4-butylphenyl)-5-(2-oxidanylidenepropyl)-1H-indeno[1,2-c]pyrazol-4-one Openeye Name: 5-acetonyl-3-(4-butylphenyl)-1H-indeno[1,2-c]pyrazol-4-one CAS Name: 3-(4-butylphenyl)-5-(2-oxopropyl)-1H-indeno[1,2-c]pyrazol-4-one IUPAC Name: 3-(4-butylphenyl)-5-(2-oxopropyl)-1H-indeno[1,2-c]pyrazol-4-one Traditional Name: 5-acetonyl-3-(4-butylphenyl)-1H-indeno[1,2-c]pyrazol-4-one Formula: C23H22N2O2 MolecularWeight: 358.43298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NNC3=C2C(=O)C4=C3C=CC=C4CC(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NNC3=C2C(=O)C4=C3C=CC=C4CC(=O)C

InChI

InChI=1S/C23H22N2O2/c1-3-4-6-15-9-11-16(12-10-15)21-20-22(25-24-21)18-8-5-7-17(13-14(2)26)19(18)23(20)27/h5,7-12H,3-4,6,13H2,1-2H3,(H,24,25)