(3-propan-2-ylphenyl) 1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxylate

Systemtic Name: (3-propan-2-ylphenyl) 1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxylate Openeye Name: (3-isopropylphenyl) 1,3-dioxo-2-(4-pyridylmethyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(pyridin-4-ylmethyl)-5-isoindolecarboxylic acid (3-propan-2-ylphenyl) ester IUPAC Name: (3-propan-2-ylphenyl) 1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-pyridylmethyl)isoindoline-5-carboxylic acid m-cumenyl ester Formula: C24H20N2O4 MolecularWeight: 400.4266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=NC=C4

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=NC=C4

InChI

InChI=1S/C24H20N2O4/c1-15(2)17-4-3-5-19(12-17)30-24(29)18-6-7-20-21(13-18)23(28)26(22(20)27)14-16-8-10-25-11-9-16/h3-13,15H,14H2,1-2H3