7-[(3-phenyl-1,2-oxazol-5-yl)methyl]azepan-2-one

Systemtic Name: 7-[(3-phenyl-1,2-oxazol-5-yl)methyl]azepan-2-one Openeye Name: 7-[(3-phenylisoxazol-5-yl)methyl]azepan-2-one CAS Name: 7-[(3-phenyl-5-isoxazolyl)methyl]-2-azepanone IUPAC Name: 7-[(3-phenyl-1,2-oxazol-5-yl)methyl]azepan-2-one Traditional Name: 7-[(3-phenylisoxazol-5-yl)methyl]azepan-2-one Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)CC2=CC(=NO2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)NC(C1)CC2=CC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N2O2/c19-16-9-5-4-8-13(17-16)10-14-11-15(18-20-14)12-6-2-1-3-7-12/h1-3,6-7,11,13H,4-5,8-10H2,(H,17,19)