2-(4-butan-2-ylphenyl)sulfonyl-3-methoxy-3-oxidanylidene-propanoate

Systemtic Name: 2-(4-butan-2-ylphenyl)sulfonyl-3-methoxy-3-oxidanylidene-propanoate Openeye Name: 3-methoxy-3-oxo-2-(4-sec-butylphenyl)sulfonyl-propanoate CAS Name: 2-(4-butan-2-ylphenyl)sulfonyl-3-methoxy-3-oxopropanoate IUPAC Name: 2-(4-butan-2-ylphenyl)sulfonyl-3-methoxy-3-oxopropanoate Traditional Name: 3-keto-3-methoxy-2-(4-sec-butylphenyl)sulfonyl-propionate Formula: C14H17O6S- MolecularWeight: 313.34618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)C(C(=O)[O-])C(=O)OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)C(C(=O)[O-])C(=O)OC

InChI

InChI=1S/C14H18O6S/c1-4-9(2)10-5-7-11(8-6-10)21(18,19)12(13(15)16)14(17)20-3/h5-9,12H,4H2,1-3H3,(H,15,16)/p-1