3-(2-methanoyl-4-methoxy-5-oxidanyl-phenyl)benzenesulfonic acid

Systemtic Name: 3-(2-methanoyl-4-methoxy-5-oxidanyl-phenyl)benzenesulfonic acid Openeye Name: 3-(2-formyl-5-hydroxy-4-methoxy-phenyl)benzenesulfonic acid CAS Name: 3-(2-formyl-5-hydroxy-4-methoxyphenyl)benzenesulfonic acid IUPAC Name: 3-(2-formyl-5-hydroxy-4-methoxyphenyl)benzenesulfonic acid Traditional Name: 3-(2-formyl-5-hydroxy-4-methoxy-phenyl)besylic acid Formula: C14H12O6S MolecularWeight: 308.30648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=O)C2=CC(=CC=C2)S(=O)(=O)O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)C=O)C2=CC(=CC=C2)S(=O)(=O)O)O

InChI

InChI=1S/C14H12O6S/c1-20-14-6-10(8-15)12(7-13(14)16)9-3-2-4-11(5-9)21(17,18)19/h2-8,16H,1H3,(H,17,18,19)