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

Systemtic Name: ethyl (2R,3R)-3-[[(2R)-1-(4-oxidanylbutylamino)-1-oxidanylidene-4-phenyl-butan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl (2R,3R)-3-[[(1R)-1-(4-hydroxybutylcarbamoyl)-3-phenyl-propyl]carbamoyl]oxirane-2-carboxylate CAS Name: (2R,3R)-3-[[[(2R)-1-(4-hydroxybutylamino)-1-oxo-4-phenylbutan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-[[(2R)-1-(4-hydroxybutylamino)-1-oxo-4-phenylbutan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: (2R,3R)-3-[[(1R)-1-(4-hydroxybutylcarbamoyl)-3-phenyl-propyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O6/c1-2-27-20(26)17-16(28-17)19(25)22-15(18(24)21-12-6-7-13-23)11-10-14-8-4-3-5-9-14/h3-5,8-9,15-17,23H,2,6-7,10-13H2,1H3,(H,21,24)(H,22,25)/t15-,16-,17-/m1/s1