3-[(3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)pyrrolidin-1-yl]propanenitrile

Systemtic Name: 3-[(3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)pyrrolidin-1-yl]propanenitrile Openeye Name: 3-[(3R,4R)-3-benzyloxy-4-(benzyloxymethyl)pyrrolidin-1-yl]propanenitrile CAS Name: 3-[(3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)-1-pyrrolidinyl]propanenitrile IUPAC Name: 3-[(3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)pyrrolidin-1-yl]propanenitrile Traditional Name: 3-[(3R,4R)-3-benzoxy-4-(benzoxymethyl)pyrrolidino]propionitrile Formula: C22H26N2O2 MolecularWeight: 350.45404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CCC#N)OCC2=CC=CC=C2)COCC3=CC=CC=C3

Isomeric SMILES

C1[C@@H]([C@H](CN1CCC#N)OCC2=CC=CC=C2)COCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2/c23-12-7-13-24-14-21(18-25-16-19-8-3-1-4-9-19)22(15-24)26-17-20-10-5-2-6-11-20/h1-6,8-11,21-22H,7,13-18H2/t21-,22+/m1/s1