(Z)-3-(4-chlorophenyl)sulfanyl-2-methyl-pent-2-enoic acid

Systemtic Name: (Z)-3-(4-chlorophenyl)sulfanyl-2-methyl-pent-2-enoic acid Openeye Name: (Z)-3-(4-chlorophenyl)sulfanyl-2-methyl-pent-2-enoic acid CAS Name: (Z)-3-[(4-chlorophenyl)thio]-2-methyl-2-pentenoic acid IUPAC Name: (Z)-3-(4-chlorophenyl)sulfanyl-2-methylpent-2-enoic acid Traditional Name: (Z)-3-[(4-chlorophenyl)thio]-2-methyl-pent-2-enoic acid Formula: C12H13ClO2S MolecularWeight: 256.74842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C)C(=O)O)SC1=CC=C(C=C1)Cl

Isomeric SMILES

CC/C(=C(\C)/C(=O)O)/SC1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H13ClO2S/c1-3-11(8(2)12(14)15)16-10-6-4-9(13)5-7-10/h4-7H,3H2,1-2H3,(H,14,15)/b11-8-