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

Systemtic Name: (2S)-1-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Openeye Name: (2S)-1-(4-benzyloxyphenoxy)-3-[[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]methylamino]propan-2-ol CAS Name: (2S)-1-[[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]methylamino]-3-(4-phenylmethoxyphenoxy)-2-propanol IUPAC Name: (2S)-1-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-benzoxyphenoxy)-3-[[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]methylamino]propan-2-ol Formula: C29H36N2O6S MolecularWeight: 540.67094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CNC[C@@H](COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C29H36N2O6S/c1-35-26-11-13-29(14-12-26)38(33,34)31-17-15-23(16-18-31)19-30-20-25(32)22-37-28-9-7-27(8-10-28)36-21-24-5-3-2-4-6-24/h2-14,23,25,30,32H,15-22H2,1H3/t25-/m0/s1