2-[3-isocyano-1-(3-methylphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]isoindole-1,3-dione

Systemtic Name: 2-[3-isocyano-1-(3-methylphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]isoindole-1,3-dione Openeye Name: 2-[3-isocyano-1-(m-tolyl)-5-oxo-4H-pyrazol-4-yl]isoindoline-1,3-dione CAS Name: 2-[3-isocyano-1-(3-methylphenyl)-5-oxo-4H-pyrazol-4-yl]isoindole-1,3-dione IUPAC Name: 2-[3-isocyano-1-(3-methylphenyl)-5-oxo-4H-pyrazol-4-yl]isoindole-1,3-dione Traditional Name: 2-[3-isocyano-5-keto-1-(m-tolyl)-2-pyrazolin-4-yl]isoindoline-1,3-quinone Formula: C19H12N4O3 MolecularWeight: 344.32358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(C(=N2)[N+]#[C-])N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C(C(=N2)[N+]#[C-])N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H12N4O3/c1-11-6-5-7-12(10-11)23-19(26)15(16(20-2)21-23)22-17(24)13-8-3-4-9-14(13)18(22)25/h3-10,15H,1H3