5-[2-[[3-(3-methyl-4-methylsulfonyl-phenoxy)-2-oxidanyl-propyl]amino]ethoxy]-2-oxidanyl-benzamide

Systemtic Name: 5-[2-[[3-(3-methyl-4-methylsulfonyl-phenoxy)-2-oxidanyl-propyl]amino]ethoxy]-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-5-[2-[[2-hydroxy-3-(3-methyl-4-methylsulfonyl-phenoxy)propyl]amino]ethoxy]benzamide CAS Name: 2-hydroxy-5-[2-[[2-hydroxy-3-(3-methyl-4-methylsulfonylphenoxy)propyl]amino]ethoxy]benzamide IUPAC Name: 2-hydroxy-5-[2-[[2-hydroxy-3-(3-methyl-4-methylsulfonylphenoxy)propyl]amino]ethoxy]benzamide Traditional Name: 2-hydroxy-5-[2-[[2-hydroxy-3-(4-mesyl-3-methyl-phenoxy)propyl]amino]ethoxy]benzamide Formula: C20H26N2O7S MolecularWeight: 438.49464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O7S/c1-13-9-15(4-6-19(13)30(2,26)27)29-12-14(23)11-22-7-8-28-16-3-5-18(24)17(10-16)20(21)25/h3-6,9-10,14,22-24H,7-8,11-12H2,1-2H3,(H2,21,25)