N-[(2-nitrophenyl)methyl]-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-[(2-nitrophenyl)methyl]-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-[(2-nitrophenyl)methyl]-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[(2-nitrophenyl)methyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-[(2-nitrophenyl)methyl]-1-propylpiperidin-1-ium-4-amine Traditional Name: (2-nitrobenzyl)-(1-propylpiperidin-1-ium-4-yl)amine Formula: C15H24N3O2+ MolecularWeight: 278.36996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC[NH+]1CCC(CC1)NCC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O2/c1-2-9-17-10-7-14(8-11-17)16-12-13-5-3-4-6-15(13)18(19)20/h3-6,14,16H,2,7-12H2,1H3/p+1