N-(4-chloranyl-2,5-dimethoxy-phenyl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-(4-chloro-2,5-dimethoxy-phenyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-(4-chloro-2,5-dimethoxy-phenyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C20H17ClN2O5 MolecularWeight: 400.81238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)OC)Cl

InChI

InChI=1S/C20H17ClN2O5/c1-4-7-23-19(25)12-6-5-11(8-13(12)20(23)26)18(24)22-15-10-16(27-2)14(21)9-17(15)28-3/h4-6,8-10H,1,7H2,2-3H3,(H,22,24)