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

Systemtic Name: 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-methyl-N-(2-phenoxyethyl)butanamide Openeye Name: 4-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-methyl-N-(2-phenoxyethyl)butanamide CAS Name: 4-(5-bromo-1,3-dioxo-2-isoindolyl)-N-methyl-N-(2-phenoxyethyl)butanamide IUPAC Name: 4-(5-bromo-1,3-dioxoisoindol-2-yl)-N-methyl-N-(2-phenoxyethyl)butanamide Traditional Name: 4-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-methyl-N-(2-phenoxyethyl)butyramide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC=C1)C(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CN(CCOC1=CC=CC=C1)C(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C21H21BrN2O4/c1-23(12-13-28-16-6-3-2-4-7-16)19(25)8-5-11-24-20(26)17-10-9-15(22)14-18(17)21(24)27/h2-4,6-7,9-10,14H,5,8,11-13H2,1H3