4-[3-(4-azanylphenoxy)-4-imidazol-1-yl-butyl]benzenecarbonitrile

Systemtic Name: 4-[3-(4-azanylphenoxy)-4-imidazol-1-yl-butyl]benzenecarbonitrile Openeye Name: 4-[3-(4-aminophenoxy)-4-imidazol-1-yl-butyl]benzonitrile CAS Name: 4-[3-(4-aminophenoxy)-4-(1-imidazolyl)butyl]benzonitrile IUPAC Name: 4-[3-(4-aminophenoxy)-4-imidazol-1-ylbutyl]benzonitrile Traditional Name: 4-[3-(4-aminophenoxy)-4-imidazol-1-yl-butyl]benzonitrile Formula: C20H20N4O MolecularWeight: 332.399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(CN2C=CN=C2)OC3=CC=C(C=C3)N)C#N

Isomeric SMILES

C1=CC(=CC=C1CCC(CN2C=CN=C2)OC3=CC=C(C=C3)N)C#N

InChI

InChI=1S/C20H20N4O/c21-13-17-3-1-16(2-4-17)5-8-20(14-24-12-11-23-15-24)25-19-9-6-18(22)7-10-19/h1-4,6-7,9-12,15,20H,5,8,14,22H2