1-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[(2-chloro-5-methylsulfanyl-benzoyl)amino]cyclohexanecarboxylic acid CAS Name: 1-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(2-chloro-5-methylsulfanylbenzoyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-chloro-5-(methylthio)benzoyl]amino]cyclohexanecarboxylic acid Formula: C15H18ClNO3S MolecularWeight: 327.82632

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)NC2(CCCCC2)C(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)NC2(CCCCC2)C(=O)O

InChI

InChI=1S/C15H18ClNO3S/c1-21-10-5-6-12(16)11(9-10)13(18)17-15(14(19)20)7-3-2-4-8-15/h5-6,9H,2-4,7-8H2,1H3,(H,17,18)(H,19,20)