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

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-4-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-4-ium Openeye Name: 1-(5-chloro-2-methyl-phenyl)-4-[(1-cyclohexyltetrazol-5-yl)methyl]piperazin-4-ium CAS Name: 1-(5-chloro-2-methylphenyl)-4-[(1-cyclohexyl-5-tetrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-(5-chloro-2-methylphenyl)-4-[(1-cyclohexyltetrazol-5-yl)methyl]piperazin-4-ium Traditional Name: 1-(5-chloro-2-methyl-phenyl)-4-[(1-cyclohexyltetrazol-5-yl)methyl]piperazin-4-ium Formula: C19H28ClN6+ MolecularWeight: 375.91882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC3=NN=NN3C4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC3=NN=NN3C4CCCCC4

InChI

InChI=1S/C19H27ClN6/c1-15-7-8-16(20)13-18(15)25-11-9-24(10-12-25)14-19-21-22-23-26(19)17-5-3-2-4-6-17/h7-8,13,17H,2-6,9-12,14H2,1H3/p+1