butyl 4-[2-[2-(furan-2-ylcarbonylamino)-3-methyl-butanoyl]oxyethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-(furan-2-ylcarbonylamino)-3-methyl-butanoyl]oxyethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-(furan-2-carbonylamino)-3-methyl-butanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[2-[[2-furanyl(oxo)methyl]amino]-3-methyl-1-oxobutoxy]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-(furan-2-carbonylamino)-3-methylbutanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[2-(2-furoylamino)-3-methyl-butanoyl]oxyacetyl]amino]benzoic acid butyl ester Formula: C23H28N2O7 MolecularWeight: 444.47762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CO2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CO2

InChI

InChI=1S/C23H28N2O7/c1-4-5-12-31-22(28)16-8-10-17(11-9-16)24-19(26)14-32-23(29)20(15(2)3)25-21(27)18-7-6-13-30-18/h6-11,13,15,20H,4-5,12,14H2,1-3H3,(H,24,26)(H,25,27)