3-(6-oxidanylidenecyclohexa-1,3-dien-1-yl)carbonylazepan-2-one

Systemtic Name: 3-(6-oxidanylidenecyclohexa-1,3-dien-1-yl)carbonylazepan-2-one Openeye Name: 3-(6-oxocyclohexa-1,3-diene-1-carbonyl)azepan-2-one CAS Name: 3-[oxo-(6-oxo-1-cyclohexa-1,3-dienyl)methyl]-2-azepanone IUPAC Name: 3-(6-oxocyclohexa-1,3-diene-1-carbonyl)azepan-2-one Traditional Name: 3-(6-ketocyclohexa-1,3-diene-1-carbonyl)azepan-2-one Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)C(=O)C2=CC=CCC2=O

Isomeric SMILES

C1CCNC(=O)C(C1)C(=O)C2=CC=CCC2=O

InChI

InChI=1S/C13H15NO3/c15-11-7-2-1-5-9(11)12(16)10-6-3-4-8-14-13(10)17/h1-2,5,10H,3-4,6-8H2,(H,14,17)