2-[2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazol-4-yl]ethanenitrile

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazol-4-yl]ethanenitrile Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazol-4-yl]acetonitrile CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazol-4-yl]acetonitrile IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazol-4-yl]acetonitrile Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazol-4-yl]acetonitrile Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)C2=CC3=C(C=C2)OCO3)CC#N

Isomeric SMILES

CC1=C(N=C(N1)C2=CC3=C(C=C2)OCO3)CC#N

InChI

InChI=1S/C13H11N3O2/c1-8-10(4-5-14)16-13(15-8)9-2-3-11-12(6-9)18-7-17-11/h2-3,6H,4,7H2,1H3,(H,15,16)