(2R)-2-[3-(4-methoxyphenyl)propanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[3-(4-methoxyphenyl)propanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[3-(4-methoxyphenyl)propanoylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[3-(4-methoxyphenyl)propanoylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[3-(4-methoxyphenyl)propanoylamino]-4-(methylthio)butyrate Formula: C15H20NO4S- MolecularWeight: 310.3886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C15H21NO4S/c1-20-12-6-3-11(4-7-12)5-8-14(17)16-13(15(18)19)9-10-21-2/h3-4,6-7,13H,5,8-10H2,1-2H3,(H,16,17)(H,18,19)/p-1/t13-/m1/s1