4-[1-(1H-imidazol-5-yl)-2,2,2-triphenyl-ethyl]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[1-(1H-imidazol-5-yl)-2,2,2-triphenyl-ethyl]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[1-(1H-imidazol-5-yl)-2,2,2-triphenyl-ethyl]-3-methoxy-benzonitrile CAS Name: 4-[1-(1H-imidazol-5-yl)-2,2,2-triphenylethyl]-3-methoxybenzonitrile IUPAC Name: 4-[1-(1H-imidazol-5-yl)-2,2,2-triphenylethyl]-3-methoxybenzonitrile Traditional Name: 4-[1-(1H-imidazol-5-yl)-2,2,2-triphenyl-ethyl]-3-methoxy-benzonitrile Formula: C31H25N3O MolecularWeight: 455.5497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)C(C2=CN=CN2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)C(C2=CN=CN2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H25N3O/c1-35-29-19-23(20-32)17-18-27(29)30(28-21-33-22-34-28)31(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-19,21-22,30H,1H3,(H,33,34)