2-butyl-N-[4-chloranyl-3-(trifluoromethyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[4-chloranyl-3-(trifluoromethyl)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-[4-chloro-3-(trifluoromethyl)phenyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C20H16ClF3N2O3 MolecularWeight: 424.80085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C20H16ClF3N2O3/c1-2-3-8-26-18(28)13-6-4-11(9-14(13)19(26)29)17(27)25-12-5-7-16(21)15(10-12)20(22,23)24/h4-7,9-10H,2-3,8H2,1H3,(H,25,27)