2-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-4-nitro-phenolate

Systemtic Name: 2-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-4-nitro-phenolate Openeye Name: 2-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]-4-nitro-phenolate CAS Name: 2-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-2-furanyl]-4-nitrophenolate IUPAC Name: 2-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl]-4-nitrophenolate Traditional Name: 2-[5-[(E)-2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-2-furyl]-4-nitro-phenolate Formula: C21H13N4O4- MolecularWeight: 385.35232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])[O-])C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])[O-])/C#N

InChI

InChI=1S/C21H14N4O4/c1-12-2-5-17-18(8-12)24-21(23-17)13(11-22)9-15-4-7-20(29-15)16-10-14(25(27)28)3-6-19(16)26/h2-10,26H,1H3,(H,23,24)/p-1/b13-9+