3-[(6-tert-butyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(6-tert-butyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(6-tert-butyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)methyl]benzonitrile CAS Name: 3-[(6-tert-butyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)methyl]benzonitrile IUPAC Name: 3-[(6-tert-butyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)methyl]benzonitrile Traditional Name: 3-[(6-tert-butyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)methyl]benzonitrile Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC3=C(C=C2N1CC4=CC=CC(=C4)C#N)OCO3

Isomeric SMILES

CC(C)(C)C1=NC2=CC3=C(C=C2N1CC4=CC=CC(=C4)C#N)OCO3

InChI

InChI=1S/C20H19N3O2/c1-20(2,3)19-22-15-8-17-18(25-12-24-17)9-16(15)23(19)11-14-6-4-5-13(7-14)10-21/h4-9H,11-12H2,1-3H3