1-[(4-methylsulfanylphenyl)carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(4-methylsulfanylphenyl)carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[(4-methylsulfanylbenzoyl)amino]cyclohexanecarboxylic acid CAS Name: 1-[[[4-(methylthio)phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(4-methylsulfanylbenzoyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[4-(methylthio)benzoyl]amino]cyclohexanecarboxylic acid Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3S/c1-20-12-7-5-11(6-8-12)13(17)16-15(14(18)19)9-3-2-4-10-15/h5-8H,2-4,9-10H2,1H3,(H,16,17)(H,18,19)