2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-N-(2,4-dimethoxyphenyl)benzamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-N-(2,4-dimethoxyphenyl)benzamide Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-N-(2,4-dimethoxyphenyl)benzamide CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]-N-(2,4-dimethoxyphenyl)benzamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-N-(2,4-dimethoxyphenyl)benzamide Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-N-(2,4-dimethoxyphenyl)benzamide Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)CCC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)CCC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C25H24N2O6/c1-30-17-9-10-20(22(14-17)31-2)27-25(29)18-5-3-4-6-19(18)26-24(28)12-8-16-7-11-21-23(13-16)33-15-32-21/h3-7,9-11,13-14H,8,12,15H2,1-2H3,(H,26,28)(H,27,29)