ethyl (2S,3S)-3-[[(2S)-4-methyl-1-oxidanylidene-1-(phenethylamino)pentan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: ethyl (2S,3S)-3-[[(2S)-4-methyl-1-oxidanylidene-1-(phenethylamino)pentan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl (2S,3S)-3-[[(1S)-3-methyl-1-(phenethylcarbamoyl)butyl]carbamoyl]oxirane-2-carboxylate CAS Name: (2S,3S)-3-[[[(2S)-4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3S)-3-[[(2S)-4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: (2S,3S)-3-[[(1S)-3-methyl-1-(phenethylcarbamoyl)butyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(O1)C(=O)NC(CC(C)C)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](O1)C(=O)N[C@@H](CC(C)C)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O5/c1-4-26-20(25)17-16(27-17)19(24)22-15(12-13(2)3)18(23)21-11-10-14-8-6-5-7-9-14/h5-9,13,15-17H,4,10-12H2,1-3H3,(H,21,23)(H,22,24)/t15-,16-,17-/m0/s1