7-(2-propan-2-ylsulfanylethanoylamino)heptanoic acid

Systemtic Name: 7-(2-propan-2-ylsulfanylethanoylamino)heptanoic acid Openeye Name: 7-[(2-isopropylsulfanylacetyl)amino]heptanoic acid CAS Name: 7-[[1-oxo-2-(propan-2-ylthio)ethyl]amino]heptanoic acid IUPAC Name: 7-[(2-propan-2-ylsulfanylacetyl)amino]heptanoic acid Traditional Name: 7-[[2-(isopropylthio)acetyl]amino]enanthic acid Formula: C12H23NO3S MolecularWeight: 261.38092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(=O)NCCCCCCC(=O)O

Isomeric SMILES

CC(C)SCC(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C12H23NO3S/c1-10(2)17-9-11(14)13-8-6-4-3-5-7-12(15)16/h10H,3-9H2,1-2H3,(H,13,14)(H,15,16)