[1-[1-(3,4-dichlorophenyl)but-3-enyl]-1-methyl-3-oxidanylidene-2H-isoindol-5-yl] ethanoate

Systemtic Name: [1-[1-(3,4-dichlorophenyl)but-3-enyl]-1-methyl-3-oxidanylidene-2H-isoindol-5-yl] ethanoate Openeye Name: [1-[1-(3,4-dichlorophenyl)but-3-enyl]-1-methyl-3-oxo-isoindolin-5-yl] acetate CAS Name: acetic acid [1-[1-(3,4-dichlorophenyl)but-3-enyl]-1-methyl-3-oxo-2H-isoindol-5-yl] ester IUPAC Name: [1-[1-(3,4-dichlorophenyl)but-3-enyl]-1-methyl-3-oxo-2H-isoindol-5-yl] acetate Traditional Name: acetic acid [1-[1-(3,4-dichlorophenyl)but-3-enyl]-3-keto-1-methyl-isoindolin-5-yl] ester Formula: C21H19Cl2NO3 MolecularWeight: 404.28646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C(NC2=O)(C)C(CC=C)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C(NC2=O)(C)C(CC=C)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H19Cl2NO3/c1-4-5-16(13-6-9-18(22)19(23)10-13)21(3)17-8-7-14(27-12(2)25)11-15(17)20(26)24-21/h4,6-11,16H,1,5H2,2-3H3,(H,24,26)