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

Systemtic Name: 1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(1-cyclohexyl-5-tetrazolyl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-(3-methoxyphenyl)piperazin-1-ium Formula: C19H29N6O+ MolecularWeight: 357.47316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NN=NN3C4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NN=NN3C4CCCCC4

InChI

InChI=1S/C19H28N6O/c1-26-18-9-5-8-17(14-18)24-12-10-23(11-13-24)15-19-20-21-22-25(19)16-6-3-2-4-7-16/h5,8-9,14,16H,2-4,6-7,10-13,15H2,1H3/p+1