(E)-3-[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[5-(4-methoxy-2-nitro-phenyl)-2-furyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[5-(4-methoxy-2-nitrophenyl)-2-furanyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: (E)-3-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[5-(4-methoxy-2-nitro-phenyl)-2-furyl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C22H16N4O4 MolecularWeight: 400.38684

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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=C(C=C4)OC)[N+](=O)[O-])C#N

Isomeric SMILES

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

InChI

InChI=1S/C22H16N4O4/c1-13-3-7-18-19(9-13)25-22(24-18)14(12-23)10-16-5-8-21(30-16)17-6-4-15(29-2)11-20(17)26(27)28/h3-11H,1-2H3,(H,24,25)/b14-10+