2-[(4-pyrazol-1-ylphenyl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-pyrazol-1-ylphenyl)methyl]isoindole-1,3-dione Openeye Name: 2-[(4-pyrazol-1-ylphenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(1-pyrazolyl)phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-pyrazol-1-ylphenyl)methyl]isoindole-1,3-dione Traditional Name: 2-(4-pyrazol-1-ylbenzyl)isoindoline-1,3-quinone Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C18H13N3O2/c22-17-15-4-1-2-5-16(15)18(23)20(17)12-13-6-8-14(9-7-13)21-11-3-10-19-21/h1-11H,12H2