7-[(3-phenyl-4,5-dihydro-1,2-oxazol-4-yl)methyl]azepan-2-one

Systemtic Name: 7-[(3-phenyl-4,5-dihydro-1,2-oxazol-4-yl)methyl]azepan-2-one Openeye Name: 7-[(3-phenyl-4,5-dihydroisoxazol-4-yl)methyl]azepan-2-one CAS Name: 7-[(3-phenyl-4,5-dihydroisoxazol-4-yl)methyl]-2-azepanone IUPAC Name: 7-[(3-phenyl-4,5-dihydro-1,2-oxazol-4-yl)methyl]azepan-2-one Traditional Name: 7-[(3-phenyl-2-isoxazolin-4-yl)methyl]azepan-2-one Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)CC2CON=C2C3=CC=CC=C3

Isomeric SMILES

C1CCC(=O)NC(C1)CC2CON=C2C3=CC=CC=C3

InChI

InChI=1S/C16H20N2O2/c19-15-9-5-4-8-14(17-15)10-13-11-20-18-16(13)12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11H2,(H,17,19)