[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C14H12N2O6 MolecularWeight: 304.25488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NCC2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NCC2=CC=CO2

InChI

InChI=1S/C14H12N2O6/c17-13(15-8-12-5-2-6-21-12)9-22-14(18)10-3-1-4-11(7-10)16(19)20/h1-7H,8-9H2,(H,15,17)