(2R)-3-phenyl-2-[[(2R)-3-phenyl-2-(2-sulfoethylamino)propanoyl]amino]propanoic acid

Systemtic Name: (2R)-3-phenyl-2-[[(2R)-3-phenyl-2-(2-sulfoethylamino)propanoyl]amino]propanoic acid Openeye Name: (2R)-3-phenyl-2-[[(2R)-3-phenyl-2-(2-sulfoethylamino)propanoyl]amino]propanoic acid CAS Name: (2R)-2-[[(2R)-1-oxo-3-phenyl-2-(2-sulfoethylamino)propyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-3-phenyl-2-[[(2R)-3-phenyl-2-(2-sulfoethylamino)propanoyl]amino]propanoic acid Traditional Name: (2R)-3-phenyl-2-[[(2R)-3-phenyl-2-(2-sulfoethylamino)propanoyl]amino]propionic acid Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CC=CC=C2)C(=O)O)NCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)N[C@H](CC2=CC=CC=C2)C(=O)O)NCCS(=O)(=O)O

InChI

InChI=1S/C20H24N2O6S/c23-19(22-18(20(24)25)14-16-9-5-2-6-10-16)17(21-11-12-29(26,27)28)13-15-7-3-1-4-8-15/h1-10,17-18,21H,11-14H2,(H,22,23)(H,24,25)(H,26,27,28)/t17-,18-/m1/s1