ethyl (2R,3R)-3-[[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-4-phenyl-butan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: ethyl (2R,3R)-3-[[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-4-phenyl-butan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl (2R,3R)-3-[[(1R)-1-(isopentylcarbamoyl)-3-phenyl-propyl]carbamoyl]oxirane-2-carboxylate CAS Name: (2R,3R)-3-[[[(2R)-1-(3-methylbutylamino)-1-oxo-4-phenylbutan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-[[(2R)-1-(3-methylbutylamino)-1-oxo-4-phenylbutan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: (2R,3R)-3-[[(1R)-1-(isoamylcarbamoyl)-3-phenyl-propyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(O1)C(=O)NC(CCC2=CC=CC=C2)C(=O)NCCC(C)C

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](O1)C(=O)N[C@H](CCC2=CC=CC=C2)C(=O)NCCC(C)C

InChI

InChI=1S/C21H30N2O5/c1-4-27-21(26)18-17(28-18)20(25)23-16(19(24)22-13-12-14(2)3)11-10-15-8-6-5-7-9-15/h5-9,14,16-18H,4,10-13H2,1-3H3,(H,22,24)(H,23,25)/t16-,17-,18-/m1/s1