2-(2-chloranyl-4-phenyl-phenyl)-2-methoxycarbonylsulfanyl-propanoic acid

Systemtic Name: 2-(2-chloranyl-4-phenyl-phenyl)-2-methoxycarbonylsulfanyl-propanoic acid Openeye Name: 2-(2-chloro-4-phenyl-phenyl)-2-methoxycarbonylsulfanyl-propanoic acid CAS Name: 2-(2-chloro-4-phenylphenyl)-2-(methoxycarbonylthio)propanoic acid IUPAC Name: 2-(2-chloro-4-phenylphenyl)-2-methoxycarbonylsulfanylpropanoic acid Traditional Name: 2-(carbomethoxythio)-2-(2-chloro-4-phenyl-phenyl)propionic acid Formula: C17H15ClO4S MolecularWeight: 350.8166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C2=CC=CC=C2)Cl)(C(=O)O)SC(=O)OC

Isomeric SMILES

CC(C1=C(C=C(C=C1)C2=CC=CC=C2)Cl)(C(=O)O)SC(=O)OC

InChI

InChI=1S/C17H15ClO4S/c1-17(15(19)20,23-16(21)22-2)13-9-8-12(10-14(13)18)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,19,20)