4-ethyl-2-methoxy-benzoic acid; methanesulfonamide

Systemtic Name: 4-ethyl-2-methoxy-benzoic acid; methanesulfonamide Openeye Name: 4-ethyl-2-methoxy-benzoic acid; methanesulfonamide CAS Name: 4-ethyl-2-methoxybenzoic acid; methanesulfonamide IUPAC Name: 4-ethyl-2-methoxybenzoic acid; methanesulfonamide Traditional Name: 4-ethyl-2-methoxy-benzoic acid; methanesulfonamide Formula: C11H17NO5S MolecularWeight: 275.32138

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C(=O)O)OC.CS(=O)(=O)N

Isomeric SMILES

CCC1=CC(=C(C=C1)C(=O)O)OC.CS(=O)(=O)N

InChI

InChI=1S/C10H12O3.CH5NO2S/c1-3-7-4-5-8(10(11)12)9(6-7)13-2;1-5(2,3)4/h4-6H,3H2,1-2H3,(H,11,12);1H3,(H2,2,3,4)