2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methyl]isoindoline-1,3-quinone Formula: C22H16N4O2 MolecularWeight: 368.38804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)CN3C(=O)C4=CC=CC=C4C3=O)N5C=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)CN3C(=O)C4=CC=CC=C4C3=O)N5C=CC=C5

InChI

InChI=1S/C22H16N4O2/c27-21-18-10-4-5-11-19(18)22(28)25(21)15-16-14-23-26(17-8-2-1-3-9-17)20(16)24-12-6-7-13-24/h1-14H,15H2