(2S,3R,4S)-1-cyclohexyl-6-methyl-2-[(phenylmethyl)amino]heptane-3,4-diol

Systemtic Name: (2S,3R,4S)-1-cyclohexyl-6-methyl-2-[(phenylmethyl)amino]heptane-3,4-diol Openeye Name: (2S,3R,4S)-2-(benzylamino)-1-cyclohexyl-6-methyl-heptane-3,4-diol CAS Name: (2S,3R,4S)-1-cyclohexyl-6-methyl-2-[(phenylmethyl)amino]heptane-3,4-diol IUPAC Name: (2S,3R,4S)-2-(benzylamino)-1-cyclohexyl-6-methylheptane-3,4-diol Traditional Name: (2S,3R,4S)-2-(benzylamino)-1-cyclohexyl-6-methyl-heptane-3,4-diol Formula: C21H35NO2 MolecularWeight: 333.5081

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(CC1CCCCC1)NCC2=CC=CC=C2)O)O

Isomeric SMILES

CC(C)C[C@@H]([C@@H]([C@H](CC1CCCCC1)NCC2=CC=CC=C2)O)O

InChI

InChI=1S/C21H35NO2/c1-16(2)13-20(23)21(24)19(14-17-9-5-3-6-10-17)22-15-18-11-7-4-8-12-18/h4,7-8,11-12,16-17,19-24H,3,5-6,9-10,13-15H2,1-2H3/t19-,20-,21+/m0/s1