(4E)-2-(3-methylphenyl)-4-[(1-phenylpyrazol-4-yl)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-2-(3-methylphenyl)-4-[(1-phenylpyrazol-4-yl)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-2-(m-tolyl)-4-[(1-phenylpyrazol-4-yl)methylene]isoquinoline-1,3-dione CAS Name: (4E)-2-(3-methylphenyl)-4-[(1-phenyl-4-pyrazolyl)methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-2-(3-methylphenyl)-4-[(1-phenylpyrazol-4-yl)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-2-(m-tolyl)-4-[(1-phenylpyrazol-4-yl)methylene]isoquinoline-1,3-quinone Formula: C26H19N3O2 MolecularWeight: 405.44796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CN(N=C4)C5=CC=CC=C5)C2=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3/C(=C\C4=CN(N=C4)C5=CC=CC=C5)/C2=O

InChI

InChI=1S/C26H19N3O2/c1-18-8-7-11-21(14-18)29-25(30)23-13-6-5-12-22(23)24(26(29)31)15-19-16-27-28(17-19)20-9-3-2-4-10-20/h2-17H,1H3/b24-15+