4,4-bis(fluoranyl)-2-methyl-3-[[(1R)-2-oxidanyl-1-phenyl-ethyl]amino]tridecan-5-one

Systemtic Name: 4,4-bis(fluoranyl)-2-methyl-3-[[(1R)-2-oxidanyl-1-phenyl-ethyl]amino]tridecan-5-one Openeye Name: 4,4-difluoro-3-[[(1R)-2-hydroxy-1-phenyl-ethyl]amino]-2-methyl-tridecan-5-one CAS Name: 4,4-difluoro-3-[[(1R)-2-hydroxy-1-phenylethyl]amino]-2-methyl-5-tridecanone IUPAC Name: 4,4-difluoro-3-[[(1R)-2-hydroxy-1-phenylethyl]amino]-2-methyltridecan-5-one Traditional Name: 4,4-difluoro-3-[[(1R)-2-hydroxy-1-phenyl-ethyl]amino]-2-methyl-tridecan-5-one Formula: C22H35F2NO2 MolecularWeight: 383.515606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C(C(C(C)C)NC(CO)C1=CC=CC=C1)(F)F

Isomeric SMILES

CCCCCCCCC(=O)C(C(C(C)C)N[C@@H](CO)C1=CC=CC=C1)(F)F

InChI

InChI=1S/C22H35F2NO2/c1-4-5-6-7-8-12-15-20(27)22(23,24)21(17(2)3)25-19(16-26)18-13-10-9-11-14-18/h9-11,13-14,17,19,21,25-26H,4-8,12,15-16H2,1-3H3/t19-,21?/m0/s1