[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-phenyl-4-pyrazolecarboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 3,5-dimethyl-1-phenylpyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylic acid phthalimidomethyl ester Formula: C21H17N3O4 MolecularWeight: 375.37738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H17N3O4/c1-13-18(14(2)24(22-13)15-8-4-3-5-9-15)21(27)28-12-23-19(25)16-10-6-7-11-17(16)20(23)26/h3-11H,12H2,1-2H3