4-(4-phenylphenyl)-4-sulfo-butanoic acid

Systemtic Name: 4-(4-phenylphenyl)-4-sulfo-butanoic acid Openeye Name: 4-(4-phenylphenyl)-4-sulfo-butanoic acid CAS Name: 4-(4-phenylphenyl)-4-sulfobutanoic acid IUPAC Name: 4-(4-phenylphenyl)-4-sulfobutanoic acid Traditional Name: 4-(4-phenylphenyl)-4-sulfo-butyric acid Formula: C16H16O5S MolecularWeight: 320.36024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O5S/c17-16(18)11-10-15(22(19,20)21)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9,15H,10-11H2,(H,17,18)(H,19,20,21)