(3S)-3-chloranyl-1-(phenylcarbonyl)azepan-2-one

Systemtic Name: (3S)-3-chloranyl-1-(phenylcarbonyl)azepan-2-one Openeye Name: (3S)-1-benzoyl-3-chloro-azepan-2-one CAS Name: (3S)-1-benzoyl-3-chloro-2-azepanone IUPAC Name: (3S)-1-benzoyl-3-chloroazepan-2-one Traditional Name: (3S)-1-benzoyl-3-chloro-azepan-2-one Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCN(C(=O)[C@H](C1)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14ClNO2/c14-11-8-4-5-9-15(13(11)17)12(16)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2/t11-/m0/s1