2-[(1,3-diphenylpyrazol-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[(1,3-diphenyl-4-pyrazolyl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C24H21N3O2 MolecularWeight: 383.44244

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H21N3O2/c28-23-20-13-7-8-14-21(20)24(29)26(23)15-18-16-27(19-11-5-2-6-12-19)25-22(18)17-9-3-1-4-10-17/h1-12,16,20-21H,13-15H2