1-[(2-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium

Systemtic Name: 1-[(2-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium Openeye Name: 1-[(2-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium CAS Name: 1-[(2-nitrophenyl)methyl]-4-(1-pyrrolidin-1-iumyl)piperidin-1-ium IUPAC Name: 1-[(2-nitrophenyl)methyl]-4-pyrrolidin-1-ium-1-ylpiperidin-1-ium Traditional Name: 1-(2-nitrobenzyl)-4-pyrrolidin-1-ium-1-yl-piperidin-1-ium Formula: C16H25N3O2+2 MolecularWeight: 291.3886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)C2CC[NH+](CC2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

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