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

Systemtic Name: 1-[[5-(3-methoxyphenyl)-1,2,3,4-tetrazol-2-yl]methyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[[5-(3-methoxyphenyl)tetrazol-2-yl]methyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[[5-(3-methoxyphenyl)-2-tetrazolyl]methyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[[5-(3-methoxyphenyl)tetrazol-2-yl]methyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[[5-(3-methoxyphenyl)tetrazol-2-yl]methyl]-4-phenyl-piperazin-1-ium Formula: C19H23N6O+ MolecularWeight: 351.42552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(N=N2)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(N=N2)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C19H22N6O/c1-26-18-9-5-6-16(14-18)19-20-22-25(21-19)15-23-10-12-24(13-11-23)17-7-3-2-4-8-17/h2-9,14H,10-13,15H2,1H3/p+1