4-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-N-ethyl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[[1-(4-ethoxyphenyl)-1,2,3,4-tetrazol-5-yl]methyl]-N-ethyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-N-ethyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[[1-(4-ethoxyphenyl)-5-tetrazolyl]methyl]-N-ethyl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[[1-(4-ethoxyphenyl)tetrazol-5-yl]methyl]-N-ethylpiperazin-4-ium-1-carboxamide Traditional Name: N-ethyl-4-[(1-p-phenetyltetrazol-5-yl)methyl]piperazin-4-ium-1-carboxamide Formula: C17H26N7O2+ MolecularWeight: 360.43404

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CC[NH+](CC1)CC2=NN=NN2C3=CC=C(C=C3)OCC

Isomeric SMILES

CCNC(=O)N1CC[NH+](CC1)CC2=NN=NN2C3=CC=C(C=C3)OCC

InChI

InChI=1S/C17H25N7O2/c1-3-18-17(25)23-11-9-22(10-12-23)13-16-19-20-21-24(16)14-5-7-15(8-6-14)26-4-2/h5-8H,3-4,9-13H2,1-2H3,(H,18,25)/p+1