methyl-(1-methylpiperidin-1-ium-4-yl)-[(3-nitrophenyl)methyl]azanium

Systemtic Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(3-nitrophenyl)methyl]azanium Openeye Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(3-nitrophenyl)methyl]ammonium CAS Name: methyl-(1-methyl-4-piperidin-1-iumyl)-[(3-nitrophenyl)methyl]ammonium IUPAC Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[(3-nitrophenyl)methyl]azanium Traditional Name: methyl-(1-methylpiperidin-1-ium-4-yl)-(3-nitrobenzyl)ammonium Formula: C14H23N3O2+2 MolecularWeight: 265.35132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2/c1-15-8-6-13(7-9-15)16(2)11-12-4-3-5-14(10-12)17(18)19/h3-5,10,13H,6-9,11H2,1-2H3/p+2