azepan-1-yl-[(5S)-3-[(4-fluorophenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methanone

Systemtic Name: azepan-1-yl-[(5S)-3-[(4-fluorophenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methanone Openeye Name: azepan-1-yl-[(5S)-3-[(4-fluorophenyl)methyl]-4,5-dihydroisoxazol-5-yl]methanone CAS Name: 1-azepanyl-[(5S)-3-[(4-fluorophenyl)methyl]-4,5-dihydroisoxazol-5-yl]methanone IUPAC Name: azepan-1-yl-[(5S)-3-[(4-fluorophenyl)methyl]-4,5-dihydro-1,2-oxazol-5-yl]methanone Traditional Name: azepan-1-yl-[(5S)-3-(4-fluorobenzyl)-2-isoxazolin-5-yl]methanone Formula: C17H21FN2O2 MolecularWeight: 304.359243

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC(=NO2)CC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)C(=O)[C@@H]2CC(=NO2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H21FN2O2/c18-14-7-5-13(6-8-14)11-15-12-16(22-19-15)17(21)20-9-3-1-2-4-10-20/h5-8,16H,1-4,9-12H2/t16-/m0/s1