2-[(E)-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]isoindole-1,3-dione

Systemtic Name: 2-[(E)-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]isoindole-1,3-dione Openeye Name: 2-[(E)-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]isoindoline-1,3-dione CAS Name: 2-[(E)-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]isoindole-1,3-dione IUPAC Name: 2-[(E)-(1-benzyl-3,5-dimethylpyrazol-4-yl)methylideneamino]isoindole-1,3-dione Traditional Name: 2-[(E)-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]isoindoline-1,3-quinone Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C=NN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=N/N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H18N4O2/c1-14-19(15(2)24(23-14)13-16-8-4-3-5-9-16)12-22-25-20(26)17-10-6-7-11-18(17)21(25)27/h3-12H,13H2,1-2H3/b22-12+