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

Systemtic Name: (2S)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-phenylmethoxyphenoxy)propan-2-ol Openeye Name: (2S)-1-(4-benzyloxyphenoxy)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]propan-2-ol CAS Name: (2S)-1-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-3-(4-phenylmethoxyphenoxy)-2-propanol IUPAC Name: (2S)-1-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-phenylmethoxyphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-benzoxyphenoxy)-3-[4-(4-methoxyphenyl)sulfonylpiperazino]propan-2-ol Formula: C27H32N2O6S MolecularWeight: 512.61778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C[C@@H](COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C27H32N2O6S/c1-33-24-11-13-27(14-12-24)36(31,32)29-17-15-28(16-18-29)19-23(30)21-35-26-9-7-25(8-10-26)34-20-22-5-3-2-4-6-22/h2-14,23,30H,15-21H2,1H3/t23-/m0/s1