2-[2-(4-ethoxyphenyl)ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-(4-ethoxyphenyl)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(4-ethoxyphenyl)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(4-ethoxyphenyl)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(4-ethoxyphenyl)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 4-(methylthio)-2-[(2-p-phenetylacetyl)amino]butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-3-20-12-6-4-11(5-7-12)10-14(17)16-13(15(18)19)8-9-21-2/h4-7,13H,3,8-10H2,1-2H3,(H,16,17)(H,18,19)