7-[2-(4-chlorophenyl)sulfanylethanoylamino]heptanoic acid

Systemtic Name: 7-[2-(4-chlorophenyl)sulfanylethanoylamino]heptanoic acid Openeye Name: 7-[[2-(4-chlorophenyl)sulfanylacetyl]amino]heptanoic acid CAS Name: 7-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]heptanoic acid IUPAC Name: 7-[[2-(4-chlorophenyl)sulfanylacetyl]amino]heptanoic acid Traditional Name: 7-[[2-[(4-chlorophenyl)thio]acetyl]amino]enanthic acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)NCCCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)NCCCCCCC(=O)O)Cl

InChI

InChI=1S/C15H20ClNO3S/c16-12-6-8-13(9-7-12)21-11-14(18)17-10-4-2-1-3-5-15(19)20/h6-9H,1-5,10-11H2,(H,17,18)(H,19,20)