5-methyl-4-[(3-nitrophenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-methyl-4-[(3-nitrophenoxy)methyl]furan-2-carboxylate Openeye Name: 5-methyl-4-[(3-nitrophenoxy)methyl]furan-2-carboxylate CAS Name: 5-methyl-4-[(3-nitrophenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-methyl-4-[(3-nitrophenoxy)methyl]furan-2-carboxylate Traditional Name: 5-methyl-4-[(3-nitrophenoxy)methyl]-2-furoate Formula: C13H10NO6- MolecularWeight: 276.2216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)[O-])COC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(O1)C(=O)[O-])COC2=CC=CC(=C2)[N+](=O)[O-]

InChI

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