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

Systemtic Name: ethyl 3-[[1-(3-butoxypropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-(3-butoxypropylamino)-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylate CAS Name: 3-[[[1-(3-butoxypropylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(3-butoxypropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: 3-[[1-benzyl-2-(3-butoxypropylamino)-2-keto-ethyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C22H32N2O6 MolecularWeight: 420.49928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N2O6/c1-3-5-13-28-14-9-12-23-20(25)17(15-16-10-7-6-8-11-16)24-21(26)18-19(30-18)22(27)29-4-2/h6-8,10-11,17-19H,3-5,9,12-15H2,1-2H3,(H,23,25)(H,24,26)