N-(6-ethanoyl-1,3-benzodioxol-5-yl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-allyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-allyl-1,3-diketo-isoindoline-5-carboxamide Formula: C21H16N2O6 MolecularWeight: 392.36154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC=C)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC=C)OCO2

InChI

InChI=1S/C21H16N2O6/c1-3-6-23-20(26)13-5-4-12(7-15(13)21(23)27)19(25)22-16-9-18-17(28-10-29-18)8-14(16)11(2)24/h3-5,7-9H,1,6,10H2,2H3,(H,22,25)