1-[(2S)-2-azanyl-2-(2,5-dimethylphenyl)ethyl]azepan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-2-(2,5-dimethylphenyl)ethyl]azepan-2-one Openeye Name: 1-[(2S)-2-amino-2-(2,5-dimethylphenyl)ethyl]azepan-2-one CAS Name: 1-[(2S)-2-amino-2-(2,5-dimethylphenyl)ethyl]-2-azepanone IUPAC Name: 1-[(2S)-2-amino-2-(2,5-dimethylphenyl)ethyl]azepan-2-one Traditional Name: 1-[(2S)-2-amino-2-(2,5-dimethylphenyl)ethyl]azepan-2-one Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O/c1-12-7-8-13(2)14(10-12)15(17)11-18-9-5-3-4-6-16(18)19/h7-8,10,15H,3-6,9,11,17H2,1-2H3/t15-/m1/s1