(1R,3R,6S)-4-methyl-6-(4-phenylbutylamino)cyclohexane-1,2,3-triol

Systemtic Name: (1R,3R,6S)-4-methyl-6-(4-phenylbutylamino)cyclohexane-1,2,3-triol Openeye Name: (1R,3R,6S)-4-methyl-6-(4-phenylbutylamino)cyclohexane-1,2,3-triol CAS Name: (1R,3R,6S)-4-methyl-6-(4-phenylbutylamino)cyclohexane-1,2,3-triol IUPAC Name: (1R,3R,6S)-4-methyl-6-(4-phenylbutylamino)cyclohexane-1,2,3-triol Traditional Name: (1R,3R,6S)-4-methyl-6-(4-phenylbutylamino)cyclohexane-1,2,3-triol Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C1O)O)O)NCCCCC2=CC=CC=C2

Isomeric SMILES

CC1C[C@@H]([C@H](C([C@@H]1O)O)O)NCCCCC2=CC=CC=C2

InChI

InChI=1S/C17H27NO3/c1-12-11-14(16(20)17(21)15(12)19)18-10-6-5-9-13-7-3-2-4-8-13/h2-4,7-8,12,14-21H,5-6,9-11H2,1H3/t12?,14-,15+,16+,17?/m0/s1