3-[1-[[(2R,3R)-4-[[1-(2-carboxyethyloxy)-2-phenyl-ethyl]amino]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoyl]amino]-2-phenyl-ethoxy]propanoic acid

Systemtic Name: 3-[1-[[(2R,3R)-4-[[1-(2-carboxyethyloxy)-2-phenyl-ethyl]amino]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoyl]amino]-2-phenyl-ethoxy]propanoic acid Openeye Name: 3-[1-[[(2R,3R)-4-[[1-(2-carboxyethyloxy)-2-phenyl-ethyl]amino]-2,3-dihydroxy-4-oxo-butanoyl]amino]-2-phenyl-ethoxy]propanoic acid CAS Name: 3-[1-[[(2R,3R)-4-[[1-(2-carboxyethyloxy)-2-phenylethyl]amino]-2,3-dihydroxy-1,4-dioxobutyl]amino]-2-phenylethoxy]propanoic acid IUPAC Name: 3-[1-[[(2R,3R)-4-[[1-(2-carboxyethyloxy)-2-phenylethyl]amino]-2,3-dihydroxy-4-oxobutanoyl]amino]-2-phenylethoxy]propanoic acid Traditional Name: 3-[1-[[(2R,3R)-4-[[1-(2-carboxyethyloxy)-2-phenyl-ethyl]amino]-2,3-dihydroxy-4-keto-butanoyl]amino]-2-phenyl-ethoxy]propionic acid Formula: C26H32N2O10 MolecularWeight: 532.53968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CC(NC(=O)[C@@H]([C@H](C(=O)NC(CC2=CC=CC=C2)OCCC(=O)O)O)O)OCCC(=O)O

InChI

InChI=1S/C26H32N2O10/c29-21(30)11-13-37-19(15-17-7-3-1-4-8-17)27-25(35)23(33)24(34)26(36)28-20(38-14-12-22(31)32)16-18-9-5-2-6-10-18/h1-10,19-20,23-24,33-34H,11-16H2,(H,27,35)(H,28,36)(H,29,30)(H,31,32)/t19?,20?,23-,24-/m1/s1