(3R,4R)-3,4-bis(phenylmethoxy)-1-(phenylmethyl)azepan-2-one

Systemtic Name: (3R,4R)-3,4-bis(phenylmethoxy)-1-(phenylmethyl)azepan-2-one Openeye Name: (3R,4R)-1-benzyl-3,4-dibenzyloxy-azepan-2-one CAS Name: (3R,4R)-3,4-bis(phenylmethoxy)-1-(phenylmethyl)-2-azepanone IUPAC Name: (3R,4R)-1-benzyl-3,4-bis(phenylmethoxy)azepan-2-one Traditional Name: (3R,4R)-3,4-dibenzoxy-1-benzyl-azepan-2-one Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(=O)N(C1)CC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C[C@H]([C@H](C(=O)N(C1)CC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29NO3/c29-27-26(31-21-24-15-8-3-9-16-24)25(30-20-23-13-6-2-7-14-23)17-10-18-28(27)19-22-11-4-1-5-12-22/h1-9,11-16,25-26H,10,17-21H2/t25-,26-/m1/s1