(5S)-1-[(1R)-1-phenylethyl]-5-(phenylmethyl)azepan-2-one

Systemtic Name: (5S)-1-[(1R)-1-phenylethyl]-5-(phenylmethyl)azepan-2-one Openeye Name: (5S)-5-benzyl-1-[(1R)-1-phenylethyl]azepan-2-one CAS Name: (5S)-1-[(1R)-1-phenylethyl]-5-(phenylmethyl)-2-azepanone IUPAC Name: (5S)-5-benzyl-1-[(1R)-1-phenylethyl]azepan-2-one Traditional Name: (5S)-5-benzyl-1-[(1R)-1-phenylethyl]azepan-2-one Formula: C21H25NO MolecularWeight: 307.4293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCC(CCC2=O)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2CC[C@@H](CCC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H25NO/c1-17(20-10-6-3-7-11-20)22-15-14-19(12-13-21(22)23)16-18-8-4-2-5-9-18/h2-11,17,19H,12-16H2,1H3/t17-,19-/m1/s1