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

Systemtic Name: 4,4-bis(fluoranyl)-2-methyl-3-[[(1R)-1-phenylethyl]amino]tridecan-5-one Openeye Name: 4,4-difluoro-2-methyl-3-[[(1R)-1-phenylethyl]amino]tridecan-5-one CAS Name: 4,4-difluoro-2-methyl-3-[[(1R)-1-phenylethyl]amino]-5-tridecanone IUPAC Name: 4,4-difluoro-2-methyl-3-[[(1R)-1-phenylethyl]amino]tridecan-5-one Traditional Name: 4,4-difluoro-2-methyl-3-[[(1R)-1-phenylethyl]amino]tridecan-5-one Formula: C22H35F2NO MolecularWeight: 367.516206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35F2NO/c1-5-6-7-8-9-13-16-20(26)22(23,24)21(17(2)3)25-18(4)19-14-11-10-12-15-19/h10-12,14-15,17-18,21,25H,5-9,13,16H2,1-4H3/t18-,21?/m1/s1