ethyl (2R,3R)-3-[[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: ethyl (2R,3R)-3-[[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl (2R,3R)-3-[[(1R)-1-(benzyloxymethyl)-2-(isopentylamino)-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylate CAS Name: (2R,3R)-3-[[[(2R)-1-(3-methylbutylamino)-1-oxo-3-phenylmethoxypropan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-[[(2R)-1-(3-methylbutylamino)-1-oxo-3-phenylmethoxypropan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: (2R,3R)-3-[[(1R)-1-(benzoxymethyl)-2-(isoamylamino)-2-keto-ethyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(O1)C(=O)NC(COCC2=CC=CC=C2)C(=O)NCCC(C)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](O1)C(=O)N[C@H](COCC2=CC=CC=C2)C(=O)NCCC(C)C

InChI

InChI=1S/C21H30N2O6/c1-4-28-21(26)18-17(29-18)20(25)23-16(19(24)22-11-10-14(2)3)13-27-12-15-8-6-5-7-9-15/h5-9,14,16-18H,4,10-13H2,1-3H3,(H,22,24)(H,23,25)/t16-,17-,18-/m1/s1