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

Systemtic Name: 2-butyl-N-(3-chloranyl-4-cyano-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-(3-chloro-4-cyano-phenyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-(3-chloro-4-cyanophenyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-(3-chloro-4-cyanophenyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-(3-chloro-4-cyano-phenyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C20H16ClN3O3 MolecularWeight: 381.81234

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)C#N)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN3O3/c1-2-3-8-24-19(26)15-7-5-12(9-16(15)20(24)27)18(25)23-14-6-4-13(11-22)17(21)10-14/h4-7,9-10H,2-3,8H2,1H3,(H,23,25)