3-(2-pentylphenyl)carbonylazepan-2-one

Systemtic Name: 3-(2-pentylphenyl)carbonylazepan-2-one Openeye Name: 3-(2-pentylbenzoyl)azepan-2-one CAS Name: 3-[oxo-(2-pentylphenyl)methyl]-2-azepanone IUPAC Name: 3-(2-pentylbenzoyl)azepan-2-one Traditional Name: 3-(2-amylbenzoyl)azepan-2-one Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1C(=O)C2CCCCNC2=O

Isomeric SMILES

CCCCCC1=CC=CC=C1C(=O)C2CCCCNC2=O

InChI

InChI=1S/C18H25NO2/c1-2-3-4-9-14-10-5-6-11-15(14)17(20)16-12-7-8-13-19-18(16)21/h5-6,10-11,16H,2-4,7-9,12-13H2,1H3,(H,19,21)