2-[[(2S)-1-(2-carboxyethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(2S)-1-(2-carboxyethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(1S)-1-benzyl-2-(2-carboxyethylamino)-2-oxo-ethyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2S)-1-(2-carboxyethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(2S)-1-(2-carboxyethylamino)-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(1S)-1-benzyl-2-(2-carboxyethylamino)-2-keto-ethyl]amino]-3-phenyl-propionic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c24-19(25)11-12-22-20(26)17(13-15-7-3-1-4-8-15)23-18(21(27)28)14-16-9-5-2-6-10-16/h1-10,17-18,23H,11-14H2,(H,22,26)(H,24,25)(H,27,28)/t17-,18?/m0/s1