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

Systemtic Name: 1-cyclopentyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium Openeye Name: 1-cyclopentyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium CAS Name: 1-cyclopentyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-cyclopentyl-4-[(4-nitrophenyl)methyl]piperazine-1,4-diium Traditional Name: 1-cyclopentyl-4-(4-nitrobenzyl)piperazine-1,4-diium Formula: C16H25N3O2+2 MolecularWeight: 291.3886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O2/c20-19(21)16-7-5-14(6-8-16)13-17-9-11-18(12-10-17)15-3-1-2-4-15/h5-8,15H,1-4,9-13H2/p+2