N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(tetrazol-1-yl)benzamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(1-tetrazolyl)benzamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(tetrazol-1-yl)benzamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(tetrazol-1-yl)benzamide Formula: C20H24N7O+ MolecularWeight: 378.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)N4C=NN=N4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)N4C=NN=N4

InChI

InChI=1S/C20H23N7O/c1-2-25-10-12-26(13-11-25)19-9-4-3-8-18(19)22-20(28)16-6-5-7-17(14-16)27-15-21-23-24-27/h3-9,14-15H,2,10-13H2,1H3,(H,22,28)/p+1