chloranylbenzene; 2-sulfanylpropanoic acid

Systemtic Name: chloranylbenzene; 2-sulfanylpropanoic acid Openeye Name: chlorobenzene; 2-sulfanylpropanoic acid CAS Name: chlorobenzene; 2-mercaptopropanoic acid IUPAC Name: chlorobenzene; 2-sulfanylpropanoic acid Traditional Name: chlorobenzene; 2-mercaptopropionic acid Formula: C9H11ClO2S MolecularWeight: 218.70044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S.C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C(=O)O)S.C1=CC=C(C=C1)Cl

InChI

InChI=1S/C6H5Cl.C3H6O2S/c7-6-4-2-1-3-5-6;1-2(6)3(4)5/h1-5H;2,6H,1H3,(H,4,5)