1-[(2-methoxy-5-nitro-phenyl)methyl]benzimidazole-2-carbonitrile

Systemtic Name: 1-[(2-methoxy-5-nitro-phenyl)methyl]benzimidazole-2-carbonitrile Openeye Name: 1-[(2-methoxy-5-nitro-phenyl)methyl]benzimidazole-2-carbonitrile CAS Name: 1-[(2-methoxy-5-nitrophenyl)methyl]-2-benzimidazolecarbonitrile IUPAC Name: 1-[(2-methoxy-5-nitrophenyl)methyl]benzimidazole-2-carbonitrile Traditional Name: 1-(2-methoxy-5-nitro-benzyl)benzimidazole-2-carbonitrile Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CN2C3=CC=CC=C3N=C2C#N

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CN2C3=CC=CC=C3N=C2C#N

InChI

InChI=1S/C16H12N4O3/c1-23-15-7-6-12(20(21)22)8-11(15)10-19-14-5-3-2-4-13(14)18-16(19)9-17/h2-8H,10H2,1H3