7-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]heptanoic acid

Systemtic Name: 7-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]heptanoic acid Openeye Name: 7-[(2-chloro-5-methylsulfanyl-benzoyl)amino]heptanoic acid CAS Name: 7-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]heptanoic acid IUPAC Name: 7-[(2-chloro-5-methylsulfanylbenzoyl)amino]heptanoic acid Traditional Name: 7-[[2-chloro-5-(methylthio)benzoyl]amino]enanthic acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)NCCCCCCC(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C15H20ClNO3S/c1-21-11-7-8-13(16)12(10-11)15(20)17-9-5-3-2-4-6-14(18)19/h7-8,10H,2-6,9H2,1H3,(H,17,20)(H,18,19)