4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-cyanophenyl)butanamide

Systemtic Name: 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-cyanophenyl)butanamide Openeye Name: 4-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(3-cyanophenyl)butanamide CAS Name: 4-(5-bromo-1,3-dioxo-2-isoindolyl)-N-(3-cyanophenyl)butanamide IUPAC Name: 4-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(3-cyanophenyl)butanamide Traditional Name: 4-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-(3-cyanophenyl)butyramide Formula: C19H14BrN3O3 MolecularWeight: 412.23676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C#N

InChI

InChI=1S/C19H14BrN3O3/c20-13-6-7-15-16(10-13)19(26)23(18(15)25)8-2-5-17(24)22-14-4-1-3-12(9-14)11-21/h1,3-4,6-7,9-10H,2,5,8H2,(H,22,24)