3-[5-(3-tert-butylphenyl)-1,2,3,4-tetrazol-1-yl]propanenitrile

Systemtic Name: 3-[5-(3-tert-butylphenyl)-1,2,3,4-tetrazol-1-yl]propanenitrile Openeye Name: 3-[5-(3-tert-butylphenyl)tetrazol-1-yl]propanenitrile CAS Name: 3-[5-(3-tert-butylphenyl)-1-tetrazolyl]propanenitrile IUPAC Name: 3-[5-(3-tert-butylphenyl)tetrazol-1-yl]propanenitrile Traditional Name: 3-[5-(3-tert-butylphenyl)tetrazol-1-yl]propionitrile Formula: C14H17N5 MolecularWeight: 255.31828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C1)C2=NN=NN2CCC#N

Isomeric SMILES

CC(C)(C)C1=CC=CC(=C1)C2=NN=NN2CCC#N

InChI

InChI=1S/C14H17N5/c1-14(2,3)12-7-4-6-11(10-12)13-16-17-18-19(13)9-5-8-15/h4,6-7,10H,5,9H2,1-3H3