(2S)-2-phenylcycloheptan-1-one

Systemtic Name: (2S)-2-phenylcycloheptan-1-one Openeye Name: (2S)-2-phenylcycloheptanone CAS Name: (2S)-2-phenyl-1-cycloheptanone IUPAC Name: (2S)-2-phenylcycloheptan-1-one Traditional Name: (2S)-2-phenylcycloheptanone Formula: C13H16O MolecularWeight: 188.26554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)CC1)C2=CC=CC=C2

Isomeric SMILES

C1CC[C@H](C(=O)CC1)C2=CC=CC=C2

InChI

InChI=1S/C13H16O/c14-13-10-6-2-5-9-12(13)11-7-3-1-4-8-11/h1,3-4,7-8,12H,2,5-6,9-10H2/t12-/m0/s1