(E)-2-cyano-3-[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[5-(4-methoxy-2-nitro-phenyl)-2-furyl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)-2-furanyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]prop-2-enoic acid Traditional Name: (E)-2-cyano-3-[5-(4-methoxy-2-nitro-phenyl)-2-furyl]acrylic acid Formula: C15H10N2O6 MolecularWeight: 314.2497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H10N2O6/c1-22-10-2-4-12(13(7-10)17(20)21)14-5-3-11(23-14)6-9(8-16)15(18)19/h2-7H,1H3,(H,18,19)/b9-6+