1,3-bis(oxidanylidene)-2-prop-2-enyl-N-[(2,4,5-trimethoxyphenyl)methyl]isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-prop-2-enyl-N-[(2,4,5-trimethoxyphenyl)methyl]isoindole-5-carboxamide Openeye Name: 2-allyl-1,3-dioxo-N-[(2,4,5-trimethoxyphenyl)methyl]isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-prop-2-enyl-N-[(2,4,5-trimethoxyphenyl)methyl]-5-isoindolecarboxamide IUPAC Name: 1,3-dioxo-2-prop-2-enyl-N-[(2,4,5-trimethoxyphenyl)methyl]isoindole-5-carboxamide Traditional Name: 2-allyl-1,3-diketo-N-(2,4,5-trimethoxybenzyl)isoindoline-5-carboxamide Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)OC)OC

InChI

InChI=1S/C22H22N2O6/c1-5-8-24-21(26)15-7-6-13(9-16(15)22(24)27)20(25)23-12-14-10-18(29-3)19(30-4)11-17(14)28-2/h5-7,9-11H,1,8,12H2,2-4H3,(H,23,25)