ethyl 4-ethanoyl-5-methyl-2-[2-[2-[(phenylmethyl)carbamoylamino]ethanoyloxy]ethanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-[2-[2-[(phenylmethyl)carbamoylamino]ethanoyloxy]ethanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-acetyl-2-[[2-[2-(benzylcarbamoylamino)acetyl]oxyacetyl]amino]-5-methyl-furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[1-oxo-2-[1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethoxy]ethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-[[2-[2-(benzylcarbamoylamino)acetyl]oxyacetyl]amino]-5-methylfuran-3-carboxylate Traditional Name: 4-acetyl-2-[[2-[2-(benzylcarbamoylamino)acetyl]oxyacetyl]amino]-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C22H25N3O8 MolecularWeight: 459.4492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C22H25N3O8/c1-4-31-21(29)19-18(13(2)26)14(3)33-20(19)25-16(27)12-32-17(28)11-24-22(30)23-10-15-8-6-5-7-9-15/h5-9H,4,10-12H2,1-3H3,(H,25,27)(H2,23,24,30)