(3-acetamidophenyl) 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (3-acetamidophenyl) 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (3-acetamidophenyl) 2-butyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-butyl-1,3-dioxo-5-isoindolecarboxylic acid (3-acetamidophenyl) ester IUPAC Name: (3-acetamidophenyl) 2-butyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-butyl-1,3-diketo-isoindoline-5-carboxylic acid (3-acetamidophenyl) ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C21H20N2O5/c1-3-4-10-23-19(25)17-9-8-14(11-18(17)20(23)26)21(27)28-16-7-5-6-15(12-16)22-13(2)24/h5-9,11-12H,3-4,10H2,1-2H3,(H,22,24)