2-butyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-[4-(dimethylaminomethyl)benzyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN(C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN(C)C

InChI

InChI=1S/C23H27N3O3/c1-4-5-12-26-22(28)19-11-10-18(13-20(19)23(26)29)21(27)24-14-16-6-8-17(9-7-16)15-25(2)3/h6-11,13H,4-5,12,14-15H2,1-3H3,(H,24,27)