1-[2-(3-oxidanylidenecyclohexen-1-yl)oxyethyl]-5-phenyl-azepan-2-one

Systemtic Name: 1-[2-(3-oxidanylidenecyclohexen-1-yl)oxyethyl]-5-phenyl-azepan-2-one Openeye Name: 1-[2-(3-oxocyclohexen-1-yl)oxyethyl]-5-phenyl-azepan-2-one CAS Name: 1-[2-[(3-oxo-1-cyclohexenyl)oxy]ethyl]-5-phenyl-2-azepanone IUPAC Name: 1-[2-(3-oxocyclohexen-1-yl)oxyethyl]-5-phenylazepan-2-one Traditional Name: 1-[2-(3-ketocyclohexen-1-yl)oxyethyl]-5-phenyl-azepan-2-one Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)OCCN2CCC(CCC2=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(=CC(=O)C1)OCCN2CCC(CCC2=O)C3=CC=CC=C3

InChI

InChI=1S/C20H25NO3/c22-18-7-4-8-19(15-18)24-14-13-21-12-11-17(9-10-20(21)23)16-5-2-1-3-6-16/h1-3,5-6,15,17H,4,7-14H2