(4-pyrazol-1-ylphenyl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 2-phthalimidopropionic acid (4-pyrazol-1-ylbenzyl) ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)N2C=CC=N2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C(=O)OCC1=CC=C(C=C1)N2C=CC=N2)N3C(=O)C4=CC=CC=C4C3=O

InChI

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