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

Systemtic Name: 1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-[(1-cyclohexyl-5-tetrazolyl)methyl]-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-(4-nitrophenyl)piperazin-1-ium Formula: C18H26N7O2+ MolecularWeight: 372.44474

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H25N7O2/c26-25(27)17-8-6-15(7-9-17)23-12-10-22(11-13-23)14-18-19-20-21-24(18)16-4-2-1-3-5-16/h6-9,16H,1-5,10-14H2/p+1