6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-[(3-methoxyphenyl)methylidene]-1-benzofuran-3-one

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-2-[(3-methoxyphenyl)methylidene]-1-benzofuran-3-one Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethoxy]-2-[(3-methoxyphenyl)methylene]benzofuran-3-one CAS Name: 6-[2-(1-azepanyl)-2-oxoethoxy]-2-[(3-methoxyphenyl)methylidene]-3-benzofuranone IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethoxy]-2-[(3-methoxyphenyl)methylidene]-1-benzofuran-3-one Traditional Name: 6-[2-(azepan-1-yl)-2-keto-ethoxy]-2-m-anisylidene-coumaran-3-one Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)N4CCCCCC4

InChI

InChI=1S/C24H25NO5/c1-28-18-8-6-7-17(13-18)14-22-24(27)20-10-9-19(15-21(20)30-22)29-16-23(26)25-11-4-2-3-5-12-25/h6-10,13-15H,2-5,11-12,16H2,1H3