2-(4-bromophenyl)sulfanyl-4-(4-chlorophenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(4-bromophenyl)sulfanyl-4-(4-chlorophenyl)-4-oxidanylidene-butanoic acid Openeye Name: 2-(4-bromophenyl)sulfanyl-4-(4-chlorophenyl)-4-oxo-butanoic acid CAS Name: 2-[(4-bromophenyl)thio]-4-(4-chlorophenyl)-4-oxobutanoic acid IUPAC Name: 2-(4-bromophenyl)sulfanyl-4-(4-chlorophenyl)-4-oxobutanoic acid Traditional Name: 2-[(4-bromophenyl)thio]-4-(4-chlorophenyl)-4-keto-butyric acid Formula: C16H12BrClO3S MolecularWeight: 399.68668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CC(C(=O)O)SC2=CC=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)CC(C(=O)O)SC2=CC=C(C=C2)Br)Cl

InChI

InChI=1S/C16H12BrClO3S/c17-11-3-7-13(8-4-11)22-15(16(20)21)9-14(19)10-1-5-12(18)6-2-10/h1-8,15H,9H2,(H,20,21)