6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-(1,3-benzodioxol-5-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-(1,3-benzodioxol-5-ylmethylidene)-1-benzofuran-3-one Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethoxy]-2-(1,3-benzodioxol-5-ylmethylene)benzofuran-3-one CAS Name: 6-[2-(1-azepanyl)-2-oxoethoxy]-2-(1,3-benzodioxol-5-ylmethylidene)-3-benzofuranone IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethoxy]-2-(1,3-benzodioxol-5-ylmethylidene)-1-benzofuran-3-one Traditional Name: 6-[2-(azepan-1-yl)-2-keto-ethoxy]-2-piperonylidene-coumaran-3-one Formula: C24H23NO6 MolecularWeight: 421.44252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3

InChI

InChI=1S/C24H23NO6/c26-23(25-9-3-1-2-4-10-25)14-28-17-6-7-18-20(13-17)31-22(24(18)27)12-16-5-8-19-21(11-16)30-15-29-19/h5-8,11-13H,1-4,9-10,14-15H2