1-[1-[2-(phenylmethyl)phenoxy]propan-2-yl]piperidine phosphate

Systemtic Name: 1-[1-[2-(phenylmethyl)phenoxy]propan-2-yl]piperidine phosphate Openeye Name: 1-[2-(2-benzylphenoxy)-1-methyl-ethyl]piperidine phosphate CAS Name: 1-[1-[2-(phenylmethyl)phenoxy]propan-2-yl]piperidine phosphate IUPAC Name: 1-[1-(2-benzylphenoxy)propan-2-yl]piperidine phosphate Traditional Name: 1-[2-(2-benzylphenoxy)-1-methyl-ethyl]piperidine phosphate Formula: C21H27NO5P-3 MolecularWeight: 404.416541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C21H27NO.H3O4P/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19;1-5(2,3)4/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3;(H3,1,2,3,4)/p-3