2-bromanyl-6-[(3-cyano-4,5-dimethyl-furan-2-yl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-bromanyl-6-[(3-cyano-4,5-dimethyl-furan-2-yl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[(3-cyano-4,5-dimethyl-2-furyl)iminomethyl]-4-nitro-phenolate CAS Name: 2-bromo-6-[(3-cyano-4,5-dimethyl-2-furanyl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-bromo-6-[(3-cyano-4,5-dimethylfuran-2-yl)iminomethyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[(3-cyano-4,5-dimethyl-2-furyl)iminomethyl]-4-nitro-phenolate Formula: C14H9BrN3O4- MolecularWeight: 363.14296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C#N)N=CC2=CC(=CC(=C2[O-])Br)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(OC(=C1C#N)N=CC2=CC(=CC(=C2[O-])Br)[N+](=O)[O-])C

InChI

InChI=1S/C14H10BrN3O4/c1-7-8(2)22-14(11(7)5-16)17-6-9-3-10(18(20)21)4-12(15)13(9)19/h3-4,6,19H,1-2H3/p-1