1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-N-[(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[(2,4,5-trimethoxyphenyl)methyl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-5-oxo-N-[(2,4,5-trimethoxyphenyl)methyl]pyrrolidine-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-5-keto-N-(2,4,5-trimethoxybenzyl)pyrrolidine-3-carboxamide Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)OC)OC

InChI

InChI=1S/C22H24N2O7/c1-27-17-9-19(29-3)18(28-2)6-13(17)10-23-22(26)14-7-21(25)24(11-14)15-4-5-16-20(8-15)31-12-30-16/h4-6,8-9,14H,7,10-12H2,1-3H3,(H,23,26)