ethyl 1-[[4-(4-methylsulfonylphenoxy)phenyl]methyl]-2-(oxidanylcarbamoyl)cyclopropane-1-carboxylate

Systemtic Name: ethyl 1-[[4-(4-methylsulfonylphenoxy)phenyl]methyl]-2-(oxidanylcarbamoyl)cyclopropane-1-carboxylate Openeye Name: ethyl 2-(hydroxycarbamoyl)-1-[[4-(4-methylsulfonylphenoxy)phenyl]methyl]cyclopropanecarboxylate CAS Name: 2-[(hydroxyamino)-oxomethyl]-1-[[4-(4-methylsulfonylphenoxy)phenyl]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(hydroxycarbamoyl)-1-[[4-(4-methylsulfonylphenoxy)phenyl]methyl]cyclopropane-1-carboxylate Traditional Name: 2-(hydroxycarbamoyl)-1-[4-(4-mesylphenoxy)benzyl]cyclopropanecarboxylic acid ethyl ester Formula: C21H23NO7S MolecularWeight: 433.47482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1C(=O)NO)CC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1(CC1C(=O)NO)CC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H23NO7S/c1-3-28-20(24)21(13-18(21)19(23)22-25)12-14-4-6-15(7-5-14)29-16-8-10-17(11-9-16)30(2,26)27/h4-11,18,25H,3,12-13H2,1-2H3,(H,22,23)