(6-bromanylnaphthalen-2-yl) 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (6-bromo-2-naphthyl) 2-butyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-butyl-1,3-dioxo-5-isoindolecarboxylic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 2-butyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-butyl-1,3-diketo-isoindoline-5-carboxylic acid (6-bromo-2-naphthyl) ester Formula: C23H18BrNO4 MolecularWeight: 452.29732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

InChI

InChI=1S/C23H18BrNO4/c1-2-3-10-25-21(26)19-9-6-16(13-20(19)22(25)27)23(28)29-18-8-5-14-11-17(24)7-4-15(14)12-18/h4-9,11-13H,2-3,10H2,1H3