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

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-(6-chloro-1,3-benzodioxol-5-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-(6-chloro-1,3-benzodioxol-5-yl)-1,3-diketo-isoindoline-5-carboxamide Formula: C19H13ClN2O5 MolecularWeight: 384.76992

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C19H13ClN2O5/c1-2-5-22-18(24)11-4-3-10(6-12(11)19(22)25)17(23)21-14-8-16-15(7-13(14)20)26-9-27-16/h2-4,6-8H,1,5,9H2,(H,21,23)