(3-nitrophenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium

Systemtic Name: (3-nitrophenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Openeye Name: (3-nitrophenyl)methyl-(1-propylpiperidin-1-ium-4-yl)ammonium CAS Name: (3-nitrophenyl)methyl-(1-propyl-4-piperidin-1-iumyl)ammonium IUPAC Name: (3-nitrophenyl)methyl-(1-propylpiperidin-1-ium-4-yl)azanium Traditional Name: (3-nitrobenzyl)-(1-propylpiperidin-1-ium-4-yl)ammonium Formula: C15H25N3O2+2 MolecularWeight: 279.3779

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

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