4-(4-carboxy-3-prop-2-enyl-phenyl)sulfonyl-2-prop-2-enyl-benzoic acid

Systemtic Name: 4-(4-carboxy-3-prop-2-enyl-phenyl)sulfonyl-2-prop-2-enyl-benzoic acid Openeye Name: 2-allyl-4-(3-allyl-4-carboxy-phenyl)sulfonyl-benzoic acid CAS Name: 4-(4-carboxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylbenzoic acid IUPAC Name: 4-(4-carboxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylbenzoic acid Traditional Name: 2-allyl-4-(3-allyl-4-carboxy-phenyl)sulfonyl-benzoic acid Formula: C20H18O6S MolecularWeight: 386.41832

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)C(=O)O)CC=C)C(=O)O

Isomeric SMILES

C=CCC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)C(=O)O)CC=C)C(=O)O

InChI

InChI=1S/C20H18O6S/c1-3-5-13-11-15(7-9-17(13)19(21)22)27(25,26)16-8-10-18(20(23)24)14(12-16)6-4-2/h3-4,7-12H,1-2,5-6H2,(H,21,22)(H,23,24)