2-[3-(4-iodophenyl)-3-oxidanylidene-1-phenyl-propyl]sulfanylethanoic acid

Systemtic Name: 2-[3-(4-iodophenyl)-3-oxidanylidene-1-phenyl-propyl]sulfanylethanoic acid Openeye Name: 2-[3-(4-iodophenyl)-3-oxo-1-phenyl-propyl]sulfanylacetic acid CAS Name: 2-[[3-(4-iodophenyl)-3-oxo-1-phenylpropyl]thio]acetic acid IUPAC Name: 2-[3-(4-iodophenyl)-3-oxo-1-phenylpropyl]sulfanylacetic acid Traditional Name: 2-[[3-(4-iodophenyl)-3-keto-1-phenyl-propyl]thio]acetic acid Formula: C17H15IO3S MolecularWeight: 426.26867

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)I)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)I)SCC(=O)O

InChI

InChI=1S/C17H15IO3S/c18-14-8-6-12(7-9-14)15(19)10-16(22-11-17(20)21)13-4-2-1-3-5-13/h1-9,16H,10-11H2,(H,20,21)