5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-carboxylate Openeye Name: 5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(4-methyl-2-nitrophenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-methyl-2-nitrophenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(4-methyl-2-nitro-phenoxy)methyl]-2-furoate Formula: C13H10NO6- MolecularWeight: 276.2216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11NO6/c1-8-2-4-11(10(6-8)14(17)18)19-7-9-3-5-12(20-9)13(15)16/h2-6H,7H2,1H3,(H,15,16)/p-1