3-but-3-ynylsulfonyl-4-methoxy-benzoic acid

Systemtic Name: 3-but-3-ynylsulfonyl-4-methoxy-benzoic acid Openeye Name: 3-but-3-ynylsulfonyl-4-methoxy-benzoic acid CAS Name: 3-but-3-ynylsulfonyl-4-methoxybenzoic acid IUPAC Name: 3-but-3-ynylsulfonyl-4-methoxybenzoic acid Traditional Name: 3-but-3-ynylsulfonyl-4-methoxy-benzoic acid Formula: C12H12O5S MolecularWeight: 268.28568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CCC#C

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CCC#C

InChI

InChI=1S/C12H12O5S/c1-3-4-7-18(15,16)11-8-9(12(13)14)5-6-10(11)17-2/h1,5-6,8H,4,7H2,2H3,(H,13,14)