4-oxidanyl-5-(phenylcarbonyl)-2-undecoxy-benzenesulfonic acid

Systemtic Name: 4-oxidanyl-5-(phenylcarbonyl)-2-undecoxy-benzenesulfonic acid Openeye Name: 5-benzoyl-4-hydroxy-2-undecoxy-benzenesulfonic acid CAS Name: 5-benzoyl-4-hydroxy-2-undecoxybenzenesulfonic acid IUPAC Name: 5-benzoyl-4-hydroxy-2-undecoxybenzenesulfonic acid Traditional Name: 5-benzoyl-4-hydroxy-2-undecoxy-besylic acid Formula: C24H32O6S MolecularWeight: 448.57228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCOC1=C(C=C(C(=C1)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C24H32O6S/c1-2-3-4-5-6-7-8-9-13-16-30-22-18-21(25)20(17-23(22)31(27,28)29)24(26)19-14-11-10-12-15-19/h10-12,14-15,17-18,25H,2-9,13,16H2,1H3,(H,27,28,29)