2-[2-[4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-[4-(o-tolyl)-1H-pyrazol-5-yl]-1-piperidyl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]-1-piperidinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-[4-[4-(o-tolyl)-1H-pyrazol-5-yl]piperidino]ethyl]isoindoline-1,3-quinone Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(NN=C2)C3CCN(CC3)C(=O)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=CC=C1C2=C(NN=C2)C3CCN(CC3)C(=O)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H24N4O3/c1-16-6-2-3-7-18(16)21-14-26-27-23(21)17-10-12-28(13-11-17)22(30)15-29-24(31)19-8-4-5-9-20(19)25(29)32/h2-9,14,17H,10-13,15H2,1H3,(H,26,27)