1-[(2S)-2-azanyl-2-(2,4,6-trimethylphenyl)ethyl]azepan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-2-(2,4,6-trimethylphenyl)ethyl]azepan-2-one Openeye Name: 1-[(2S)-2-amino-2-(2,4,6-trimethylphenyl)ethyl]azepan-2-one CAS Name: 1-[(2S)-2-amino-2-(2,4,6-trimethylphenyl)ethyl]-2-azepanone IUPAC Name: 1-[(2S)-2-amino-2-(2,4,6-trimethylphenyl)ethyl]azepan-2-one Traditional Name: 1-[(2S)-2-amino-2-mesityl-ethyl]azepan-2-one Formula: C17H26N2O MolecularWeight: 274.40114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(CN2CCCCCC2=O)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)[C@@H](CN2CCCCCC2=O)N)C

InChI

InChI=1S/C17H26N2O/c1-12-9-13(2)17(14(3)10-12)15(18)11-19-8-6-4-5-7-16(19)20/h9-10,15H,4-8,11,18H2,1-3H3/t15-/m1/s1