2-[4-chloranyl-2-(3-cyanophenyl)phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-chloranyl-2-(3-cyanophenyl)phenyl]sulfanylethanoic acid Openeye Name: 2-[4-chloro-2-(3-cyanophenyl)phenyl]sulfanylacetic acid CAS Name: 2-[[4-chloro-2-(3-cyanophenyl)phenyl]thio]acetic acid IUPAC Name: 2-[4-chloro-2-(3-cyanophenyl)phenyl]sulfanylacetic acid Traditional Name: 2-[[4-chloro-2-(3-cyanophenyl)phenyl]thio]acetic acid Formula: C15H10ClNO2S MolecularWeight: 303.7634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(C=CC(=C2)Cl)SCC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(C=CC(=C2)Cl)SCC(=O)O)C#N

InChI

InChI=1S/C15H10ClNO2S/c16-12-4-5-14(20-9-15(18)19)13(7-12)11-3-1-2-10(6-11)8-17/h1-7H,9H2,(H,18,19)