(2R)-2-[[2-(2-oxidanylethanoylamino)-4-sulfanyl-butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[[2-(2-oxidanylethanoylamino)-4-sulfanyl-butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[2-[(2-hydroxyacetyl)amino]-4-sulfanyl-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[2-[(2-hydroxy-1-oxoethyl)amino]-4-mercapto-1-oxobutyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[2-[(2-hydroxyacetyl)amino]-4-sulfanylbutanoyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[2-(glycoloylamino)-4-mercapto-butanoyl]amino]-3-phenyl-propionic acid Formula: C15H20N2O5S MolecularWeight: 340.3947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(CCS)NC(=O)CO

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)C(CCS)NC(=O)CO

InChI

InChI=1S/C15H20N2O5S/c18-9-13(19)16-11(6-7-23)14(20)17-12(15(21)22)8-10-4-2-1-3-5-10/h1-5,11-12,18,23H,6-9H2,(H,16,19)(H,17,20)(H,21,22)/t11?,12-/m1/s1