4-(hydroxymethyl)-2-(oxan-2-yloxymethyl)-1-(phenylmethyl)pyrrolidine-3-carbonitrile

Systemtic Name: 4-(hydroxymethyl)-2-(oxan-2-yloxymethyl)-1-(phenylmethyl)pyrrolidine-3-carbonitrile Openeye Name: 1-benzyl-4-(hydroxymethyl)-2-(tetrahydropyran-2-yloxymethyl)pyrrolidine-3-carbonitrile CAS Name: 4-(hydroxymethyl)-2-(2-oxanyloxymethyl)-1-(phenylmethyl)-3-pyrrolidinecarbonitrile IUPAC Name: 1-benzyl-4-(hydroxymethyl)-2-(oxan-2-yloxymethyl)pyrrolidine-3-carbonitrile Traditional Name: 1-benzyl-4-methylol-2-(tetrahydropyran-2-yloxymethyl)pyrrolidine-3-carbonitrile Formula: C19H26N2O3 MolecularWeight: 330.42134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC2C(C(CN2CC3=CC=CC=C3)CO)C#N

Isomeric SMILES

C1CCOC(C1)OCC2C(C(CN2CC3=CC=CC=C3)CO)C#N

InChI

InChI=1S/C19H26N2O3/c20-10-17-16(13-22)12-21(11-15-6-2-1-3-7-15)18(17)14-24-19-8-4-5-9-23-19/h1-3,6-7,16-19,22H,4-5,8-9,11-14H2