(2-chloranyl-4-fluoranyl-phenyl)methyl 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 2-butyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-butyl-1,3-dioxo-5-isoindolecarboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 2-butyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-butyl-1,3-diketo-isoindoline-5-carboxylic acid (2-chloro-4-fluoro-benzyl) ester Formula: C20H17ClFNO4 MolecularWeight: 389.804683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H17ClFNO4/c1-2-3-8-23-18(24)15-7-5-12(9-16(15)19(23)25)20(26)27-11-13-4-6-14(22)10-17(13)21/h4-7,9-10H,2-3,8,11H2,1H3