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

Systemtic Name: 3-[2-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-1-oxidanyl-ethyl]phenol Openeye Name: 3-[2-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-1-hydroxy-ethyl]phenol CAS Name: 3-[2-[[1-(4-butoxyphenyl)sulfonyl-3-azetidinyl]amino]-1-hydroxyethyl]phenol IUPAC Name: 3-[2-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-1-hydroxyethyl]phenol Traditional Name: 3-[2-[[1-(4-butoxyphenyl)sulfonylazetidin-3-yl]amino]-1-hydroxy-ethyl]phenol Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O5S/c1-2-3-11-28-19-7-9-20(10-8-19)29(26,27)23-14-17(15-23)22-13-21(25)16-5-4-6-18(24)12-16/h4-10,12,17,21-22,24-25H,2-3,11,13-15H2,1H3