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

Systemtic Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-2-hydroxy-propoxy]phenol CAS Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonyl-3-azetidinyl]amino]-2-hydroxypropoxy]phenol IUPAC Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-2-hydroxypropoxy]phenol Traditional Name: 4-[(2S)-3-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-2-hydroxy-propoxy]phenol Formula: C22H30N2O6S MolecularWeight: 450.5484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CC(C2)NCC(COC3=CC=C(C=C3)O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CC(C2)NC[C@@H](COC3=CC=C(C=C3)O)O

InChI

InChI=1S/C22H30N2O6S/c1-2-3-12-29-20-8-10-22(11-9-20)31(27,28)24-14-17(15-24)23-13-19(26)16-30-21-6-4-18(25)5-7-21/h4-11,17,19,23,25-26H,2-3,12-16H2,1H3/t19-/m0/s1