(2R)-2-[[(2S)-2-azanylpropanoyl]oxy-phenethylsulfonyl-amino]propanoic acid

Systemtic Name: (2R)-2-[[(2S)-2-azanylpropanoyl]oxy-phenethylsulfonyl-amino]propanoic acid Openeye Name: (2R)-2-[[(2S)-2-aminopropanoyl]oxy-phenethylsulfonyl-amino]propanoic acid CAS Name: (2R)-2-[[(2S)-2-amino-1-oxopropoxy]-phenethylsulfonylamino]propanoic acid IUPAC Name: (2R)-2-[[(2S)-2-aminopropanoyl]oxy-phenethylsulfonylamino]propanoic acid Traditional Name: (2R)-2-[[(2S)-2-aminopropanoyl]oxy-phenethylsulfonyl-amino]propionic acid Formula: C14H20N2O6S MolecularWeight: 344.3834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)ON(C(C)C(=O)O)S(=O)(=O)CCC1=CC=CC=C1)N

Isomeric SMILES

C[C@@H](C(=O)ON([C@H](C)C(=O)O)S(=O)(=O)CCC1=CC=CC=C1)N

InChI

InChI=1S/C14H20N2O6S/c1-10(15)14(19)22-16(11(2)13(17)18)23(20,21)9-8-12-6-4-3-5-7-12/h3-7,10-11H,8-9,15H2,1-2H3,(H,17,18)/t10-,11+/m0/s1