[3-(furan-2-ylmethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3-methyl-4-nitro-benzoate

Systemtic Name: [3-(furan-2-ylmethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3-methyl-4-nitro-benzoate Openeye Name: [3-(2-furylmethylcarbamoyl)-2-oxo-chromen-7-yl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [3-[(2-furanylmethylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(furan-2-ylmethylcarbamoyl)-2-oxochromen-7-yl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [3-(2-furfurylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C23H16N2O8 MolecularWeight: 448.38174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O8/c1-13-9-15(5-7-19(13)25(29)30)22(27)32-16-6-4-14-10-18(23(28)33-20(14)11-16)21(26)24-12-17-3-2-8-31-17/h2-11H,12H2,1H3,(H,24,26)