4-[[4-(3-oxidanylidene-3-phenylmethoxy-propyl)phenyl]methyl]benzenesulfonic acid

Systemtic Name: 4-[[4-(3-oxidanylidene-3-phenylmethoxy-propyl)phenyl]methyl]benzenesulfonic acid Openeye Name: 4-[[4-(3-benzyloxy-3-oxo-propyl)phenyl]methyl]benzenesulfonic acid CAS Name: 4-[[4-(3-oxo-3-phenylmethoxypropyl)phenyl]methyl]benzenesulfonic acid IUPAC Name: 4-[[4-(3-oxo-3-phenylmethoxypropyl)phenyl]methyl]benzenesulfonic acid Traditional Name: 4-[4-(3-benzoxy-3-keto-propyl)benzyl]besylic acid Formula: C23H22O5S MolecularWeight: 410.48278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC2=CC=C(C=C2)CC3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC2=CC=C(C=C2)CC3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C23H22O5S/c24-23(28-17-21-4-2-1-3-5-21)15-12-18-6-8-19(9-7-18)16-20-10-13-22(14-11-20)29(25,26)27/h1-11,13-14H,12,15-17H2,(H,25,26,27)