(2S,3S)-3-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]carbamoyl]oxirane-2-carboxylic acid

Systemtic Name: (2S,3S)-3-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]carbamoyl]oxirane-2-carboxylic acid Openeye Name: (2S,3S)-3-[[(1S)-2-anilino-1-benzyl-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylic acid CAS Name: (2S,3S)-3-[[[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid IUPAC Name: (2S,3S)-3-[[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylic acid Traditional Name: (2S,3S)-3-[[(1S)-2-anilino-1-benzyl-2-keto-ethyl]carbamoyl]oxirane-2-carboxylic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=CC=C2)NC(=O)C3C(O3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC=CC=C2)NC(=O)[C@@H]3[C@H](O3)C(=O)O

InChI

InChI=1S/C19H18N2O5/c22-17(20-13-9-5-2-6-10-13)14(11-12-7-3-1-4-8-12)21-18(23)15-16(26-15)19(24)25/h1-10,14-16H,11H2,(H,20,22)(H,21,23)(H,24,25)/t14-,15-,16-/m0/s1