1-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol

Systemtic Name: 1-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Openeye Name: 1-(4-benzyloxyphenoxy)-3-[[1-(p-tolylsulfonyl)-4-piperidyl]methylamino]propan-2-ol CAS Name: 1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]methylamino]-3-(4-phenylmethoxyphenoxy)-2-propanol IUPAC Name: 1-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Traditional Name: 1-(4-benzoxyphenoxy)-3-[(1-tosyl-4-piperidyl)methylamino]propan-2-ol Formula: C29H36N2O5S MolecularWeight: 524.67154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C29H36N2O5S/c1-23-7-13-29(14-8-23)37(33,34)31-17-15-24(16-18-31)19-30-20-26(32)22-36-28-11-9-27(10-12-28)35-21-25-5-3-2-4-6-25/h2-14,24,26,30,32H,15-22H2,1H3