3-[4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-N,2-dimethyl-benzamide

Systemtic Name: 3-[4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-N,2-dimethyl-benzamide Openeye Name: 3-[4-(5-bromo-1,3-dioxo-isoindolin-2-yl)butanoylamino]-N,2-dimethyl-benzamide CAS Name: 3-[[4-(5-bromo-1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-N,2-dimethylbenzamide IUPAC Name: 3-[4-(5-bromo-1,3-dioxoisoindol-2-yl)butanoylamino]-N,2-dimethylbenzamide Traditional Name: 3-[4-(5-bromo-1,3-diketo-isoindolin-2-yl)butanoylamino]-N,2-dimethyl-benzamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C(=O)NC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)C(=O)NC

InChI

InChI=1S/C21H20BrN3O4/c1-12-14(19(27)23-2)5-3-6-17(12)24-18(26)7-4-10-25-20(28)15-9-8-13(22)11-16(15)21(25)29/h3,5-6,8-9,11H,4,7,10H2,1-2H3,(H,23,27)(H,24,26)