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

Systemtic Name: ethyl 1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[2-(1,3-dioxo-2-isoindolyl)ethyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(1,3-dioxoisoindol-2-yl)ethyl]-5-methylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-(2-phthalimidoethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C17H17N3O4/c1-3-24-17(23)14-10-18-20(11(14)2)9-8-19-15(21)12-6-4-5-7-13(12)16(19)22/h4-7,10H,3,8-9H2,1-2H3