ethyl 2-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: ethyl 2-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl 2-[[(1S)-2-anilino-1-benzyl-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylate CAS Name: 2-[[[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: 2-[[(1S)-2-anilino-1-benzyl-2-keto-ethyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CO1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CO1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5/c1-2-27-20(26)21(14-28-21)19(25)23-17(13-15-9-5-3-6-10-15)18(24)22-16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,22,24)(H,23,25)/t17-,21?/m0/s1