[1-(furan-2-yl)-3-oxidanylidene-butan-2-yl] 4-nitrobenzoate

Systemtic Name: [1-(furan-2-yl)-3-oxidanylidene-butan-2-yl] 4-nitrobenzoate Openeye Name: [1-(2-furylmethyl)-2-oxo-propyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [1-(2-furanyl)-3-oxobutan-2-yl] ester IUPAC Name: [1-(furan-2-yl)-3-oxobutan-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [1-(2-furfuryl)-2-keto-propyl] ester Formula: C15H13NO6 MolecularWeight: 303.26682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CO1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(CC1=CC=CO1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO6/c1-10(17)14(9-13-3-2-8-21-13)22-15(18)11-4-6-12(7-5-11)16(19)20/h2-8,14H,9H2,1H3