(phenylmethyl) 3,6-bis(azanyl)-2-cyclohexyl-5,5-bis(fluoranyl)-4-oxidanyl-nonanoate

Systemtic Name: (phenylmethyl) 3,6-bis(azanyl)-2-cyclohexyl-5,5-bis(fluoranyl)-4-oxidanyl-nonanoate Openeye Name: benzyl 3,6-diamino-2-cyclohexyl-5,5-difluoro-4-hydroxy-nonanoate CAS Name: 3,6-diamino-2-cyclohexyl-5,5-difluoro-4-hydroxynonanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3,6-diamino-2-cyclohexyl-5,5-difluoro-4-hydroxynonanoate Traditional Name: 3,6-diamino-2-cyclohexyl-5,5-difluoro-4-hydroxy-pelargonic acid benzyl ester Formula: C22H34F2N2O3 MolecularWeight: 412.513766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C(C(C(C1CCCCC1)C(=O)OCC2=CC=CC=C2)N)O)(F)F)N

Isomeric SMILES

CCCC(C(C(C(C(C1CCCCC1)C(=O)OCC2=CC=CC=C2)N)O)(F)F)N

InChI

InChI=1S/C22H34F2N2O3/c1-2-9-17(25)22(23,24)20(27)19(26)18(16-12-7-4-8-13-16)21(28)29-14-15-10-5-3-6-11-15/h3,5-6,10-11,16-20,27H,2,4,7-9,12-14,25-26H2,1H3