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

Systemtic Name: ethyl 3-[[1-(3-ethoxypropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-(3-ethoxypropylamino)-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylate CAS Name: 3-[[[1-(3-ethoxypropylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(3-ethoxypropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: 3-[[1-benzyl-2-(3-ethoxypropylamino)-2-keto-ethyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)OCC

Isomeric SMILES

CCOCCCNC(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)OCC

InChI

InChI=1S/C20H28N2O6/c1-3-26-12-8-11-21-18(23)15(13-14-9-6-5-7-10-14)22-19(24)16-17(28-16)20(25)27-4-2/h5-7,9-10,15-17H,3-4,8,11-13H2,1-2H3,(H,21,23)(H,22,24)