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

Systemtic Name: 1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl]-4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium Openeye Name: 1-[(1-tert-butyltetrazol-5-yl)methyl]-4-(5-chloro-2-methyl-phenyl)piperazin-1-ium CAS Name: 1-[(1-tert-butyl-5-tetrazolyl)methyl]-4-(5-chloro-2-methylphenyl)piperazin-1-ium IUPAC Name: 1-[(1-tert-butyltetrazol-5-yl)methyl]-4-(5-chloro-2-methylphenyl)piperazin-1-ium Traditional Name: 1-[(1-tert-butyltetrazol-5-yl)methyl]-4-(5-chloro-2-methyl-phenyl)piperazin-1-ium Formula: C17H26ClN6+ MolecularWeight: 349.88154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC3=NN=NN3C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC3=NN=NN3C(C)(C)C

InChI

InChI=1S/C17H25ClN6/c1-13-5-6-14(18)11-15(13)23-9-7-22(8-10-23)12-16-19-20-21-24(16)17(2,3)4/h5-6,11H,7-10,12H2,1-4H3/p+1