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

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-butanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-4-(1,3-dioxoisoindolin-2-yl)-N-methyl-butanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-(1,3-dioxo-2-isoindolyl)-N-methylbutanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-(1,3-dioxoisoindol-2-yl)-N-methylbutanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-N-methyl-4-phthalimido-butyramide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21BrN2O4/c1-23(13-14-12-15(22)9-10-18(14)28-2)19(25)8-5-11-24-20(26)16-6-3-4-7-17(16)21(24)27/h3-4,6-7,9-10,12H,5,8,11,13H2,1-2H3