3-(1,3-benzodioxol-5-yl)-N-[[5-(2-ethanoylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[[5-(2-ethanoylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]propanamide Openeye Name: N-[[5-(2-acetylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-(1,3-benzodioxol-5-yl)propanamide CAS Name: N-[[5-(2-acetylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-(1,3-benzodioxol-5-yl)propanamide IUPAC Name: N-[[5-(2-acetylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-(1,3-benzodioxol-5-yl)propanamide Traditional Name: N-[[5-(2-acetylphenyl)coumaran-2-yl]methyl]-3-(1,3-benzodioxol-5-yl)propionamide Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1C2=CC3=C(C=C2)OC(C3)CNC(=O)CCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(=O)C1=CC=CC=C1C2=CC3=C(C=C2)OC(C3)CNC(=O)CCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H25NO5/c1-17(29)22-4-2-3-5-23(22)19-8-10-24-20(13-19)14-21(33-24)15-28-27(30)11-7-18-6-9-25-26(12-18)32-16-31-25/h2-6,8-10,12-13,21H,7,11,14-16H2,1H3,(H,28,30)