[4-(1-benzofuran-2-yl)-7-methyl-2-oxidanylidene-chromen-6-yl] 3-nitrobenzoate

Systemtic Name: [4-(1-benzofuran-2-yl)-7-methyl-2-oxidanylidene-chromen-6-yl] 3-nitrobenzoate Openeye Name: [4-(benzofuran-2-yl)-7-methyl-2-oxo-chromen-6-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-(2-benzofuranyl)-7-methyl-2-oxo-1-benzopyran-6-yl] ester IUPAC Name: [4-(1-benzofuran-2-yl)-7-methyl-2-oxochromen-6-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(benzofuran-2-yl)-2-keto-7-methyl-chromen-6-yl] ester Formula: C25H15NO7 MolecularWeight: 441.3891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC4=CC=CC=C4O3)OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC4=CC=CC=C4O3)OC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H15NO7/c1-14-9-22-18(12-21(14)33-25(28)16-6-4-7-17(10-16)26(29)30)19(13-24(27)32-22)23-11-15-5-2-3-8-20(15)31-23/h2-13H,1H3