1-butyl-2-(3,4-dimethoxyphenyl)benzimidazole-5-carbonitrile

Systemtic Name: 1-butyl-2-(3,4-dimethoxyphenyl)benzimidazole-5-carbonitrile Openeye Name: 1-butyl-2-(3,4-dimethoxyphenyl)benzimidazole-5-carbonitrile CAS Name: 1-butyl-2-(3,4-dimethoxyphenyl)-5-benzimidazolecarbonitrile IUPAC Name: 1-butyl-2-(3,4-dimethoxyphenyl)benzimidazole-5-carbonitrile Traditional Name: 1-butyl-2-(3,4-dimethoxyphenyl)benzimidazole-5-carbonitrile Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C#N)N=C1C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C#N)N=C1C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H21N3O2/c1-4-5-10-23-17-8-6-14(13-21)11-16(17)22-20(23)15-7-9-18(24-2)19(12-15)25-3/h6-9,11-12H,4-5,10H2,1-3H3