3-(2-propan-2-ylphenyl)carbonylazepan-2-one

Systemtic Name: 3-(2-propan-2-ylphenyl)carbonylazepan-2-one Openeye Name: 3-(2-isopropylbenzoyl)azepan-2-one CAS Name: 3-[oxo-(2-propan-2-ylphenyl)methyl]-2-azepanone IUPAC Name: 3-(2-propan-2-ylbenzoyl)azepan-2-one Traditional Name: 3-(2-isopropylbenzoyl)azepan-2-one Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1C(=O)C2CCCCNC2=O

Isomeric SMILES

CC(C)C1=CC=CC=C1C(=O)C2CCCCNC2=O

InChI

InChI=1S/C16H21NO2/c1-11(2)12-7-3-4-8-13(12)15(18)14-9-5-6-10-17-16(14)19/h3-4,7-8,11,14H,5-6,9-10H2,1-2H3,(H,17,19)