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

Systemtic Name: 1-(2-ethoxyphenyl)-4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(2-ethoxyphenyl)-4-[(5-phenyltetrazol-2-yl)methyl]piperazin-4-ium CAS Name: 1-(2-ethoxyphenyl)-4-[(5-phenyl-2-tetrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-ethoxyphenyl)-4-[(5-phenyltetrazol-2-yl)methyl]piperazin-4-ium Traditional Name: 1-o-phenetyl-4-[(5-phenyltetrazol-2-yl)methyl]piperazin-4-ium Formula: C20H25N6O+ MolecularWeight: 365.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CN3N=C(N=N3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CN3N=C(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N6O/c1-2-27-19-11-7-6-10-18(19)25-14-12-24(13-15-25)16-26-22-20(21-23-26)17-8-4-3-5-9-17/h3-11H,2,12-16H2,1H3/p+1