ethyl 4-[2-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butanoyl]oxyethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(furan-2-ylmethylamino)-4-oxidanylidene-butanoyl]oxyethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[4-(2-furylmethylamino)-4-oxo-butanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[4-(2-furanylmethylamino)-1,4-dioxobutoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(furan-2-ylmethylamino)-4-oxobutanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[4-(2-furfurylamino)-4-keto-butanoyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCC(=O)NCC2=CC=CO2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCC(=O)NCC2=CC=CO2

InChI

InChI=1S/C20H22N2O7/c1-2-27-20(26)14-5-7-15(8-6-14)22-18(24)13-29-19(25)10-9-17(23)21-12-16-4-3-11-28-16/h3-8,11H,2,9-10,12-13H2,1H3,(H,21,23)(H,22,24)