4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-(2-methanoylphenyl)benzenecarbonitrile

Systemtic Name: 4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-(2-methanoylphenyl)benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-(2-formylphenyl)benzonitrile CAS Name: 4-[(4-cyanophenyl)methoxy-(3-methyl-4-imidazolyl)methyl]-2-(2-formylphenyl)benzonitrile IUPAC Name: 4-[(4-cyanophenyl)methoxy-(3-methylimidazol-4-yl)methyl]-2-(2-formylphenyl)benzonitrile Traditional Name: 4-[(4-cyanobenzyl)oxy-(3-methylimidazol-4-yl)methyl]-2-(2-formylphenyl)benzonitrile Formula: C27H20N4O2 MolecularWeight: 432.4733

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC(=C(C=C2)C#N)C3=CC=CC=C3C=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

CN1C=NC=C1C(C2=CC(=C(C=C2)C#N)C3=CC=CC=C3C=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H20N4O2/c1-31-18-30-15-26(31)27(33-17-20-8-6-19(13-28)7-9-20)21-10-11-22(14-29)25(12-21)24-5-3-2-4-23(24)16-32/h2-12,15-16,18,27H,17H2,1H3