1-cyclopentyl-4-[(2-nitrophenyl)methyl]piperazine-1,4-diium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2/c20-19(21)16-8-4-1-5-14(16)13-17-9-11-18(12-10-17)15-6-2-3-7-15/h1,4-5,8,15H,2-3,6-7,9-13H2/p+2