1-(3-iodanylprop-2-ynyl)-5-(phenylmethyl)-1,2,3,4-tetrazole

Systemtic Name: 1-(3-iodanylprop-2-ynyl)-5-(phenylmethyl)-1,2,3,4-tetrazole Openeye Name: 5-benzyl-1-(3-iodoprop-2-ynyl)tetrazole CAS Name: 1-(3-iodoprop-2-ynyl)-5-(phenylmethyl)tetrazole IUPAC Name: 5-benzyl-1-(3-iodoprop-2-ynyl)tetrazole Traditional Name: 5-benzyl-1-(3-iodoprop-2-ynyl)tetrazole Formula: C11H9IN4 MolecularWeight: 324.12043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=NN2CC#CI

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=NN2CC#CI

InChI

InChI=1S/C11H9IN4/c12-7-4-8-16-11(13-14-15-16)9-10-5-2-1-3-6-10/h1-3,5-6H,8-9H2