2-butyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-diketo-isoindoline-5-carboxamide Formula: C22H22N2O5 MolecularWeight: 394.42048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H22N2O5/c1-2-3-9-24-21(26)16-7-5-14(12-17(16)22(24)27)20(25)23-15-6-8-18-19(13-15)29-11-4-10-28-18/h5-8,12-13H,2-4,9-11H2,1H3,(H,23,25)