2-(methylamino)-2-[3-(1,2,3,4-tetrazol-1-yl)phenyl]propanenitrile

Systemtic Name: 2-(methylamino)-2-[3-(1,2,3,4-tetrazol-1-yl)phenyl]propanenitrile Openeye Name: 2-(methylamino)-2-[3-(tetrazol-1-yl)phenyl]propanenitrile CAS Name: 2-(methylamino)-2-[3-(1-tetrazolyl)phenyl]propanenitrile IUPAC Name: 2-(methylamino)-2-[3-(tetrazol-1-yl)phenyl]propanenitrile Traditional Name: 2-(methylamino)-2-[3-(tetrazol-1-yl)phenyl]propionitrile Formula: C11H12N6 MolecularWeight: 228.25318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC(=CC=C1)N2C=NN=N2)NC

Isomeric SMILES

CC(C#N)(C1=CC(=CC=C1)N2C=NN=N2)NC

InChI

InChI=1S/C11H12N6/c1-11(7-12,13-2)9-4-3-5-10(6-9)17-8-14-15-16-17/h3-6,8,13H,1-2H3