methyl 4-[[3-(furan-2-ylmethylamino)-2-(furan-2-ylmethylcarbamoyl)-3-oxidanylidene-prop-1-enyl]amino]benzoate

Systemtic Name: methyl 4-[[3-(furan-2-ylmethylamino)-2-(furan-2-ylmethylcarbamoyl)-3-oxidanylidene-prop-1-enyl]amino]benzoate Openeye Name: methyl 4-[[3-(2-furylmethylamino)-2-(2-furylmethylcarbamoyl)-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 4-[[3-(2-furanylmethylamino)-2-[(2-furanylmethylamino)-oxomethyl]-3-oxoprop-1-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(furan-2-ylmethylamino)-2-(furan-2-ylmethylcarbamoyl)-3-oxoprop-1-enyl]amino]benzoate Traditional Name: 4-[[3-(2-furfurylamino)-2-(2-furfurylcarbamoyl)-3-keto-prop-1-enyl]amino]benzoic acid methyl ester Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC=C(C(=O)NCC2=CC=CO2)C(=O)NCC3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC=C(C(=O)NCC2=CC=CO2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H21N3O6/c1-29-22(28)15-6-8-16(9-7-15)23-14-19(20(26)24-12-17-4-2-10-30-17)21(27)25-13-18-5-3-11-31-18/h2-11,14,23H,12-13H2,1H3,(H,24,26)(H,25,27)