1-cyclohexyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-cyclohexyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium Openeye Name: 1-cyclohexyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium CAS Name: 1-cyclohexyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-cyclohexyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium Traditional Name: 1-cyclohexyl-4-(4-nitrobenzyl)piperazine-1,4-diium Formula: C17H27N3O2+2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O2/c21-20(22)17-8-6-15(7-9-17)14-18-10-12-19(13-11-18)16-4-2-1-3-5-16/h6-9,16H,1-5,10-14H2/p+2