5-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(5-ethylsulfonyl-2-oxidanyl-phenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-(5-ethylsulfonyl-2-hydroxy-anilino)-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-(5-ethylsulfonyl-2-hydroxyanilino)-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-(5-ethylsulfonyl-2-hydroxyanilino)-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-(5-esyl-2-hydroxy-anilino)-5-keto-3,3-dimethyl-valeric acid Formula: C15H21NO6S MolecularWeight: 343.39534

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CC(C)(C)CC(=O)O

InChI

InChI=1S/C15H21NO6S/c1-4-23(21,22)10-5-6-12(17)11(7-10)16-13(18)8-15(2,3)9-14(19)20/h5-7,17H,4,8-9H2,1-3H3,(H,16,18)(H,19,20)