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

Systemtic Name: ethyl 1-[[4-[(4-methylsulfanylphenyl)methoxy]phenyl]methyl]-2-(oxidanylcarbamoyl)cyclopropane-1-carboxylate Openeye Name: ethyl 2-(hydroxycarbamoyl)-1-[[4-[(4-methylsulfanylphenyl)methoxy]phenyl]methyl]cyclopropanecarboxylate CAS Name: 2-[(hydroxyamino)-oxomethyl]-1-[[4-[[4-(methylthio)phenyl]methoxy]phenyl]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(hydroxycarbamoyl)-1-[[4-[(4-methylsulfanylphenyl)methoxy]phenyl]methyl]cyclopropane-1-carboxylate Traditional Name: 2-(hydroxycarbamoyl)-1-[4-[4-(methylthio)benzyl]oxybenzyl]cyclopropanecarboxylic acid ethyl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC1C(=O)NO)CC2=CC=C(C=C2)OCC3=CC=C(C=C3)SC

Isomeric SMILES

CCOC(=O)C1(CC1C(=O)NO)CC2=CC=C(C=C2)OCC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H25NO5S/c1-3-27-21(25)22(13-19(22)20(24)23-26)12-15-4-8-17(9-5-15)28-14-16-6-10-18(29-2)11-7-16/h4-11,19,26H,3,12-14H2,1-2H3,(H,23,24)