2-(2-methoxycyclohexa-1,5-dien-1-yl)benzenesulfonic acid

Systemtic Name: 2-(2-methoxycyclohexa-1,5-dien-1-yl)benzenesulfonic acid Openeye Name: 2-(2-methoxycyclohexa-1,5-dien-1-yl)benzenesulfonic acid CAS Name: 2-(2-methoxy-1-cyclohexa-1,5-dienyl)benzenesulfonic acid IUPAC Name: 2-(2-methoxycyclohexa-1,5-dien-1-yl)benzenesulfonic acid Traditional Name: 2-(2-methoxycyclohexa-1,5-dien-1-yl)besylic acid Formula: C13H14O4S MolecularWeight: 266.31286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CCC1)C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

COC1=C(C=CCC1)C2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C13H14O4S/c1-17-12-8-4-2-6-10(12)11-7-3-5-9-13(11)18(14,15)16/h2-3,5-7,9H,4,8H2,1H3,(H,14,15,16)