[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(6-oxidanyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(6-oxidanyl-1-benzofuran-3-yl)ethanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-(6-hydroxybenzofuran-3-yl)acetate CAS Name: 2-(6-hydroxy-3-benzofuranyl)acetic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-(6-hydroxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-hydroxybenzofuran-3-yl)acetic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)CC2=COC3=C2C=CC(=C3)O

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)CC2=COC3=C2C=CC(=C3)O

InChI

InChI=1S/C18H21NO5/c20-14-5-6-15-13(11-23-16(15)10-14)9-18(22)24-12-17(21)19-7-3-1-2-4-8-19/h5-6,10-11,20H,1-4,7-9,12H2