6-[2-(4-methoxyphenyl)sulfanylethanoylamino]hexanoic acid

Systemtic Name: 6-[2-(4-methoxyphenyl)sulfanylethanoylamino]hexanoic acid Openeye Name: 6-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]hexanoic acid CAS Name: 6-[[2-[(4-methoxyphenyl)thio]-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]hexanoic acid Traditional Name: 6-[[2-[(4-methoxyphenyl)thio]acetyl]amino]hexanoic acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)NCCCCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C15H21NO4S/c1-20-12-6-8-13(9-7-12)21-11-14(17)16-10-4-2-3-5-15(18)19/h6-9H,2-5,10-11H2,1H3,(H,16,17)(H,18,19)