6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-3-one

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-3-one Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethoxy]-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-3-one CAS Name: 6-[2-(1-azepanyl)-2-oxoethoxy]-2-[(3,4,5-trimethoxyphenyl)methylidene]-3-benzofuranone IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethoxy]-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-3-one Traditional Name: 6-[2-(azepan-1-yl)-2-keto-ethoxy]-2-(3,4,5-trimethoxybenzylidene)coumaran-3-one Formula: C26H29NO7 MolecularWeight: 467.51096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)N4CCCCCC4

InChI

InChI=1S/C26H29NO7/c1-30-22-13-17(14-23(31-2)26(22)32-3)12-21-25(29)19-9-8-18(15-20(19)34-21)33-16-24(28)27-10-6-4-5-7-11-27/h8-9,12-15H,4-7,10-11,16H2,1-3H3