(2S,3S,4R)-3-phenylmethoxy-4-[(phenylmethyl)amino]octane-1,2-diol

Systemtic Name: (2S,3S,4R)-3-phenylmethoxy-4-[(phenylmethyl)amino]octane-1,2-diol Openeye Name: (2S,3S,4R)-4-(benzylamino)-3-benzyloxy-octane-1,2-diol CAS Name: (2S,3S,4R)-3-phenylmethoxy-4-[(phenylmethyl)amino]octane-1,2-diol IUPAC Name: (2S,3S,4R)-4-(benzylamino)-3-phenylmethoxyoctane-1,2-diol Traditional Name: (2S,3S,4R)-3-benzoxy-4-(benzylamino)octane-1,2-diol Formula: C22H31NO3 MolecularWeight: 357.48644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(CO)O)OCC1=CC=CC=C1)NCC2=CC=CC=C2

Isomeric SMILES

CCCC[C@H]([C@@H]([C@H](CO)O)OCC1=CC=CC=C1)NCC2=CC=CC=C2

InChI

InChI=1S/C22H31NO3/c1-2-3-14-20(23-15-18-10-6-4-7-11-18)22(21(25)16-24)26-17-19-12-8-5-9-13-19/h4-13,20-25H,2-3,14-17H2,1H3/t20-,21+,22+/m1/s1