2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(5-methylpyrazol-1-yl)benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(5-methylpyrazol-1-yl)benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-(5-methylpyrazol-1-yl)benzoate CAS Name: 4-(5-methyl-1-pyrazolyl)benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-(5-methylpyrazol-1-yl)benzoate Traditional Name: 4-(5-methylpyrazol-1-yl)benzoic acid 2-phthalimidoethyl ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H17N3O4/c1-14-10-11-22-24(14)16-8-6-15(7-9-16)21(27)28-13-12-23-19(25)17-4-2-3-5-18(17)20(23)26/h2-11H,12-13H2,1H3