2-[2-(2,2-dimethylbutanoylamino)phenyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-(2,2-dimethylbutanoylamino)phenyl]sulfanylpropanoic acid Openeye Name: 2-[2-(2,2-dimethylbutanoylamino)phenyl]sulfanylpropanoic acid CAS Name: 2-[[2-[(2,2-dimethyl-1-oxobutyl)amino]phenyl]thio]propanoic acid IUPAC Name: 2-[2-(2,2-dimethylbutanoylamino)phenyl]sulfanylpropanoic acid Traditional Name: 2-[[2-(2,2-dimethylbutanoylamino)phenyl]thio]propionic acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NC1=CC=CC=C1SC(C)C(=O)O

Isomeric SMILES

CCC(C)(C)C(=O)NC1=CC=CC=C1SC(C)C(=O)O

InChI

InChI=1S/C15H21NO3S/c1-5-15(3,4)14(19)16-11-8-6-7-9-12(11)20-10(2)13(17)18/h6-10H,5H2,1-4H3,(H,16,19)(H,17,18)