2-oxidanyl-4-[(3-phenoxyphenyl)methylsulfonyl]butanoic acid

Systemtic Name: 2-oxidanyl-4-[(3-phenoxyphenyl)methylsulfonyl]butanoic acid Openeye Name: 2-hydroxy-4-[(3-phenoxyphenyl)methylsulfonyl]butanoic acid CAS Name: 2-hydroxy-4-[(3-phenoxyphenyl)methylsulfonyl]butanoic acid IUPAC Name: 2-hydroxy-4-[(3-phenoxyphenyl)methylsulfonyl]butanoic acid Traditional Name: 2-hydroxy-4-(3-phenoxybenzyl)sulfonyl-butyric acid Formula: C17H18O6S MolecularWeight: 350.38622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CS(=O)(=O)CCC(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CS(=O)(=O)CCC(C(=O)O)O

InChI

InChI=1S/C17H18O6S/c18-16(17(19)20)9-10-24(21,22)12-13-5-4-8-15(11-13)23-14-6-2-1-3-7-14/h1-8,11,16,18H,9-10,12H2,(H,19,20)