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

Systemtic Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonylpiperidin-4-yl]amino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonyl-4-piperidyl]amino]-2-hydroxy-propoxy]phenol CAS Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonyl-4-piperidinyl]amino]-2-hydroxypropoxy]phenol IUPAC Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonylpiperidin-4-yl]amino]-2-hydroxypropoxy]phenol Traditional Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonyl-4-piperidyl]amino]-2-hydroxy-propoxy]phenol Formula: C24H34N2O6S MolecularWeight: 478.60156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NCC(COC3=CC=C(C=C3)O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC[C@@H](COC3=CC=C(C=C3)O)O

InChI

InChI=1S/C24H34N2O6S/c1-2-3-16-31-22-8-10-24(11-9-22)33(29,30)26-14-12-19(13-15-26)25-17-21(28)18-32-23-6-4-20(27)5-7-23/h4-11,19,21,25,27-28H,2-3,12-18H2,1H3/t21-/m0/s1