[4-[2-[4-(3-methoxypropylamino)-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-[2-[4-(3-methoxypropylamino)-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] furan-2-carboxylate Openeye Name: [4-[2-[4-(3-methoxypropylamino)-4-oxo-butanoyl]oxyacetyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[2-[4-(3-methoxypropylamino)-1,4-dioxobutoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-(3-methoxypropylamino)-4-oxobutanoyl]oxyacetyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[2-[4-keto-4-(3-methoxypropylamino)butanoyl]oxyacetyl]phenyl] ester Formula: C21H23NO8 MolecularWeight: 417.40922

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CCC(=O)OCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CO2

Isomeric SMILES

COCCCNC(=O)CCC(=O)OCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CO2

InChI

InChI=1S/C21H23NO8/c1-27-12-3-11-22-19(24)9-10-20(25)29-14-17(23)15-5-7-16(8-6-15)30-21(26)18-4-2-13-28-18/h2,4-8,13H,3,9-12,14H2,1H3,(H,22,24)