2-[3-(azepan-1-ylcarbonyl)phenoxy]ethanoate

Systemtic Name: 2-[3-(azepan-1-ylcarbonyl)phenoxy]ethanoate Openeye Name: 2-[3-(azepane-1-carbonyl)phenoxy]acetate CAS Name: 2-[3-[1-azepanyl(oxo)methyl]phenoxy]acetate IUPAC Name: 2-[3-(azepane-1-carbonyl)phenoxy]acetate Traditional Name: 2-[3-(azepane-1-carbonyl)phenoxy]acetate Formula: C15H18NO4- MolecularWeight: 276.30772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)OCC(=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CC=C2)OCC(=O)[O-]

InChI

InChI=1S/C15H19NO4/c17-14(18)11-20-13-7-5-6-12(10-13)15(19)16-8-3-1-2-4-9-16/h5-7,10H,1-4,8-9,11H2,(H,17,18)/p-1