2-[5-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)ethanamide

Systemtic Name: 2-[5-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)ethanamide Openeye Name: 2-[5-(azepan-1-ium-1-ylmethyl)tetrazol-1-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)acetamide CAS Name: 2-[5-(1-azepan-1-iumylmethyl)-1-tetrazolyl]-N-ethyl-N-[2-(1-pyrazolyl)ethyl]acetamide IUPAC Name: 2-[5-(azepan-1-ium-1-ylmethyl)tetrazol-1-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)acetamide Traditional Name: 2-[5-(azepan-1-ium-1-ylmethyl)tetrazol-1-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)acetamide Formula: C17H29N8O+ MolecularWeight: 361.46516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN1C=CC=N1)C(=O)CN2C(=NN=N2)C[NH+]3CCCCCC3

Isomeric SMILES

CCN(CCN1C=CC=N1)C(=O)CN2C(=NN=N2)C[NH+]3CCCCCC3

InChI

InChI=1S/C17H28N8O/c1-2-23(12-13-24-11-7-8-18-24)17(26)15-25-16(19-20-21-25)14-22-9-5-3-4-6-10-22/h7-8,11H,2-6,9-10,12-15H2,1H3/p+1