N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-butyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-butyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-butyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-butyl-1,3-diketo-isoindoline-5-carboxamide Formula: C21H19BrN2O5 MolecularWeight: 459.28996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C21H19BrN2O5/c1-2-3-6-24-20(26)13-5-4-12(9-14(13)21(24)27)19(25)23-16-11-18-17(10-15(16)22)28-7-8-29-18/h4-5,9-11H,2-3,6-8H2,1H3,(H,23,25)