1-(azepan-1-yl)-2-[5-methoxy-2-(phenylcarbonyl)phenoxy]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[5-methoxy-2-(phenylcarbonyl)phenoxy]ethanone Openeye Name: 1-(azepan-1-yl)-2-(2-benzoyl-5-methoxy-phenoxy)ethanone CAS Name: 1-(1-azepanyl)-2-(2-benzoyl-5-methoxyphenoxy)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2-benzoyl-5-methoxyphenoxy)ethanone Traditional Name: 1-(azepan-1-yl)-2-(2-benzoyl-5-methoxy-phenoxy)ethanone Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OCC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OCC(=O)N3CCCCCC3

InChI

InChI=1S/C22H25NO4/c1-26-18-11-12-19(22(25)17-9-5-4-6-10-17)20(15-18)27-16-21(24)23-13-7-2-3-8-14-23/h4-6,9-12,15H,2-3,7-8,13-14,16H2,1H3