(3E)-3-ethoxyimino-2-[[4-[(4-methylsulfonyloxyphenyl)methoxy]phenyl]methyl]butanoic acid

Systemtic Name: (3E)-3-ethoxyimino-2-[[4-[(4-methylsulfonyloxyphenyl)methoxy]phenyl]methyl]butanoic acid Openeye Name: (3E)-3-ethoxyimino-2-[[4-[(4-methylsulfonyloxyphenyl)methoxy]phenyl]methyl]butanoic acid CAS Name: (3E)-3-ethoxyimino-2-[[4-[(4-methylsulfonyloxyphenyl)methoxy]phenyl]methyl]butanoic acid IUPAC Name: (3E)-3-ethoxyimino-2-[[4-[(4-methylsulfonyloxyphenyl)methoxy]phenyl]methyl]butanoic acid Traditional Name: (3E)-3-ethyloximino-2-[4-(4-methylsulfonyloxybenzyl)oxybenzyl]butyric acid Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(C)C(CC1=CC=C(C=C1)OCC2=CC=C(C=C2)OS(=O)(=O)C)C(=O)O

Isomeric SMILES

CCO/N=C(\C)/C(CC1=CC=C(C=C1)OCC2=CC=C(C=C2)OS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C21H25NO7S/c1-4-28-22-15(2)20(21(23)24)13-16-5-9-18(10-6-16)27-14-17-7-11-19(12-8-17)29-30(3,25)26/h5-12,20H,4,13-14H2,1-3H3,(H,23,24)/b22-15+