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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 1-(4-bromophenyl)-5-methyl-pyrazole-4-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 1-(4-bromophenyl)-5-methyl-pyrazole-4-carboxylate CAS Name: 1-(4-bromophenyl)-5-methyl-4-pyrazolecarboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 1-(4-bromophenyl)-5-methylpyrazole-4-carboxylate Traditional Name: 1-(4-bromophenyl)-5-methyl-pyrazole-4-carboxylic acid phthalimidomethyl ester Formula: C20H14BrN3O4 MolecularWeight: 440.24686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14BrN3O4/c1-12-17(10-22-24(12)14-8-6-13(21)7-9-14)20(27)28-11-23-18(25)15-4-2-3-5-16(15)19(23)26/h2-10H,11H2,1H3