(E)-2-(2-methanoylphenyl)-7-(phenylsulfonyl)hept-6-enoic acid

Systemtic Name: (E)-2-(2-methanoylphenyl)-7-(phenylsulfonyl)hept-6-enoic acid Openeye Name: (E)-7-(benzenesulfonyl)-2-(2-formylphenyl)hept-6-enoic acid CAS Name: (E)-7-(benzenesulfonyl)-2-(2-formylphenyl)-6-heptenoic acid IUPAC Name: (E)-7-(benzenesulfonyl)-2-(2-formylphenyl)hept-6-enoic acid Traditional Name: (E)-7-besyl-2-(2-formylphenyl)hept-6-enoic acid Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C=CCCCC(C2=CC=CC=C2C=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C=C/CCCC(C2=CC=CC=C2C=O)C(=O)O

InChI

InChI=1S/C20H20O5S/c21-15-16-9-6-7-12-18(16)19(20(22)23)13-5-2-8-14-26(24,25)17-10-3-1-4-11-17/h1,3-4,6-12,14-15,19H,2,5,13H2,(H,22,23)/b14-8+