(4E)-4-[(1-methylpyrazol-4-yl)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-4-[(1-methylpyrazol-4-yl)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-4-[(1-methylpyrazol-4-yl)methylene]isoquinoline-1,3-dione CAS Name: (4E)-4-[(1-methyl-4-pyrazolyl)methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-4-[(1-methylpyrazol-4-yl)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-4-[(1-methylpyrazol-4-yl)methylene]isoquinoline-1,3-quinone Formula: C14H11N3O2 MolecularWeight: 253.25604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=C2C3=CC=CC=C3C(=O)NC2=O

Isomeric SMILES

CN1C=C(C=N1)/C=C/2\C3=CC=CC=C3C(=O)NC2=O

InChI

InChI=1S/C14H11N3O2/c1-17-8-9(7-15-17)6-12-10-4-2-3-5-11(10)13(18)16-14(12)19/h2-8H,1H3,(H,16,18,19)/b12-6+