4-chloranyl-N-[1,3,4-tris(oxidanylidene)isoquinolin-6-yl]butanamide

Systemtic Name: 4-chloranyl-N-[1,3,4-tris(oxidanylidene)isoquinolin-6-yl]butanamide Openeye Name: 4-chloro-N-(1,3,4-trioxo-6-isoquinolyl)butanamide CAS Name: 4-chloro-N-(1,3,4-trioxo-6-isoquinolinyl)butanamide IUPAC Name: 4-chloro-N-(1,3,4-trioxoisoquinolin-6-yl)butanamide Traditional Name: 4-chloro-N-(1,3,4-triketo-6-isoquinolyl)butyramide Formula: C13H11ClN2O4 MolecularWeight: 294.69044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CCCCl)C(=O)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CCCCl)C(=O)C(=O)NC2=O

InChI

InChI=1S/C13H11ClN2O4/c14-5-1-2-10(17)15-7-3-4-8-9(6-7)11(18)13(20)16-12(8)19/h3-4,6H,1-2,5H2,(H,15,17)(H,16,19,20)