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

Systemtic Name: 2-(propylamino)-2-[3-(1,2,3,4-tetrazol-1-yl)phenyl]propanenitrile Openeye Name: 2-(propylamino)-2-[3-(tetrazol-1-yl)phenyl]propanenitrile CAS Name: 2-(propylamino)-2-[3-(1-tetrazolyl)phenyl]propanenitrile IUPAC Name: 2-(propylamino)-2-[3-(tetrazol-1-yl)phenyl]propanenitrile Traditional Name: 2-(propylamino)-2-[3-(tetrazol-1-yl)phenyl]propionitrile Formula: C13H16N6 MolecularWeight: 256.30634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N6/c1-3-7-15-13(2,9-14)11-5-4-6-12(8-11)19-10-16-17-18-19/h4-6,8,10,15H,3,7H2,1-2H3