(3R)-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-1-ium-3-ol

Systemtic Name: (3R)-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-1-ium-3-ol Openeye Name: (3R)-1-[(4-benzyloxy-3-methoxy-phenyl)methyl]piperidin-1-ium-3-ol CAS Name: (3R)-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3R)-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-ol Traditional Name: (3R)-1-(4-benzoxy-3-methoxy-benzyl)piperidin-1-ium-3-ol Formula: C20H26NO3+ MolecularWeight: 328.42534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CCCC(C2)O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CCC[C@H](C2)O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H25NO3/c1-23-20-12-17(13-21-11-5-8-18(22)14-21)9-10-19(20)24-15-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,18,22H,5,8,11,13-15H2,1H3/p+1/t18-/m1/s1