2-[4-oxidanyl-4-oxidanylidene-1-(4-phenylphenyl)butan-2-yl]sulfanylcarbonylbenzoic acid

Systemtic Name: 2-[4-oxidanyl-4-oxidanylidene-1-(4-phenylphenyl)butan-2-yl]sulfanylcarbonylbenzoic acid Openeye Name: 2-[3-hydroxy-3-oxo-1-[(4-phenylphenyl)methyl]propyl]sulfanylcarbonylbenzoic acid CAS Name: 2-[[[4-hydroxy-4-oxo-1-(4-phenylphenyl)butan-2-yl]thio]-oxomethyl]benzoic acid IUPAC Name: 2-[4-hydroxy-4-oxo-1-(4-phenylphenyl)butan-2-yl]sulfanylcarbonylbenzoic acid Traditional Name: 2-[[3-hydroxy-3-keto-1-(4-phenylbenzyl)propyl]thio]carbonylbenzoic acid Formula: C24H20O5S MolecularWeight: 420.4776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(CC(=O)O)SC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(CC(=O)O)SC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C24H20O5S/c25-22(26)15-19(30-24(29)21-9-5-4-8-20(21)23(27)28)14-16-10-12-18(13-11-16)17-6-2-1-3-7-17/h1-13,19H,14-15H2,(H,25,26)(H,27,28)