N-butyl-4-[4-[[3-[3-(methylsulfonylamino)-4-oxidanyl-phenoxy]-2-oxidanyl-propyl]amino]piperidin-1-yl]benzamide

Systemtic Name: N-butyl-4-[4-[[3-[3-(methylsulfonylamino)-4-oxidanyl-phenoxy]-2-oxidanyl-propyl]amino]piperidin-1-yl]benzamide Openeye Name: N-butyl-4-[4-[[2-hydroxy-3-[4-hydroxy-3-(methanesulfonamido)phenoxy]propyl]amino]-1-piperidyl]benzamide CAS Name: N-butyl-4-[4-[[2-hydroxy-3-[4-hydroxy-3-(methanesulfonamido)phenoxy]propyl]amino]-1-piperidinyl]benzamide IUPAC Name: N-butyl-4-[4-[[2-hydroxy-3-[4-hydroxy-3-(methanesulfonamido)phenoxy]propyl]amino]piperidin-1-yl]benzamide Traditional Name: N-butyl-4-[4-[[2-hydroxy-3-[4-hydroxy-3-(methanesulfonamido)phenoxy]propyl]amino]piperidino]benzamide Formula: C26H38N4O6S MolecularWeight: 534.66812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)N2CCC(CC2)NCC(COC3=CC(=C(C=C3)O)NS(=O)(=O)C)O

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)N2CCC(CC2)NCC(COC3=CC(=C(C=C3)O)NS(=O)(=O)C)O

InChI

InChI=1S/C26H38N4O6S/c1-3-4-13-27-26(33)19-5-7-21(8-6-19)30-14-11-20(12-15-30)28-17-22(31)18-36-23-9-10-25(32)24(16-23)29-37(2,34)35/h5-10,16,20,22,28-29,31-32H,3-4,11-15,17-18H2,1-2H3,(H,27,33)