4-[[3-chloranyl-3-(2-chloroethylsulfanyl)propanoyl]amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[3-chloranyl-3-(2-chloroethylsulfanyl)propanoyl]amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[3-chloro-3-(2-chloroethylsulfanyl)propanoyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[3-chloro-3-(2-chloroethylthio)-1-oxopropyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[3-chloro-3-(2-chloroethylsulfanyl)propanoyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[3-chloro-3-(2-chloroethylthio)propanoyl]amino]cyclohexanecarboxylic acid Formula: C12H19Cl2NO3S MolecularWeight: 328.25516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NC(=O)CC(SCCCl)Cl

Isomeric SMILES

C1CC(CCC1C(=O)O)NC(=O)CC(SCCCl)Cl

InChI

InChI=1S/C12H19Cl2NO3S/c13-5-6-19-10(14)7-11(16)15-9-3-1-8(2-4-9)12(17)18/h8-10H,1-7H2,(H,15,16)(H,17,18)