N-(5-chloranyl-2-oxidanyl-phenyl)-2-(3-methylpentan-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-2-(3-methylpentan-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(5-chloro-2-hydroxy-phenyl)-2-(1,2-dimethylbutyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-2-(3-methylpentan-2-yl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(5-chloro-2-hydroxyphenyl)-2-(3-methylpentan-2-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(5-chloro-2-hydroxy-phenyl)-2-(1,2-dimethylbutyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

CCC(C)C(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C21H21ClN2O4/c1-4-11(2)12(3)24-20(27)15-7-5-13(9-16(15)21(24)28)19(26)23-17-10-14(22)6-8-18(17)25/h5-12,25H,4H2,1-3H3,(H,23,26)