4-[(2S)-3-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]amino]-2-oxidanyl-propoxy]phenol

Systemtic Name: 4-[(2S)-3-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]amino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[(2S)-2-hydroxy-3-[[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]amino]propoxy]phenol CAS Name: 4-[(2S)-2-hydroxy-3-[[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]amino]propoxy]phenol IUPAC Name: 4-[(2S)-2-hydroxy-3-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]amino]propoxy]phenol Traditional Name: 4-[(2S)-2-hydroxy-3-[[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]amino]propoxy]phenol Formula: C21H28N2O6S MolecularWeight: 436.52182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NCC(COC3=CC=C(C=C3)O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O6S/c1-28-19-6-8-21(9-7-19)30(26,27)23-12-10-16(11-13-23)22-14-18(25)15-29-20-4-2-17(24)3-5-20/h2-9,16,18,22,24-25H,10-15H2,1H3/t18-/m0/s1