1-ethenyl-3-pyridin-4-ylcarbonyl-azepan-2-one

Systemtic Name: 1-ethenyl-3-pyridin-4-ylcarbonyl-azepan-2-one Openeye Name: 3-(pyridine-4-carbonyl)-1-vinyl-azepan-2-one CAS Name: 1-ethenyl-3-[oxo(pyridin-4-yl)methyl]-2-azepanone IUPAC Name: 1-ethenyl-3-(pyridine-4-carbonyl)azepan-2-one Traditional Name: 3-isonicotinoyl-1-vinyl-azepan-2-one Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1CCCCC(C1=O)C(=O)C2=CC=NC=C2

Isomeric SMILES

C=CN1CCCCC(C1=O)C(=O)C2=CC=NC=C2

InChI

InChI=1S/C14H16N2O2/c1-2-16-10-4-3-5-12(14(16)18)13(17)11-6-8-15-9-7-11/h2,6-9,12H,1,3-5,10H2