(3S,4R)-4-phenylmethoxy-1-(phenylmethyl)azepan-3-ol

Systemtic Name: (3S,4R)-4-phenylmethoxy-1-(phenylmethyl)azepan-3-ol Openeye Name: (3S,4R)-1-benzyl-4-benzyloxy-azepan-3-ol CAS Name: (3S,4R)-4-phenylmethoxy-1-(phenylmethyl)-3-azepanol IUPAC Name: (3S,4R)-1-benzyl-4-phenylmethoxyazepan-3-ol Traditional Name: (3S,4R)-4-benzoxy-1-benzyl-azepan-3-ol Formula: C20H25NO2 MolecularWeight: 311.418

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CN(C1)CC2=CC=CC=C2)O)OCC3=CC=CC=C3

Isomeric SMILES

C1C[C@H]([C@H](CN(C1)CC2=CC=CC=C2)O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H25NO2/c22-19-15-21(14-17-8-3-1-4-9-17)13-7-12-20(19)23-16-18-10-5-2-6-11-18/h1-6,8-11,19-20,22H,7,12-16H2/t19-,20+/m0/s1