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

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3-nitrophenyl)methyl]azanium Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3-nitrophenyl)methyl]ammonium CAS Name: 3-(4-methyl-1-piperazin-4-iumyl)propyl-[(3-nitrophenyl)methyl]ammonium IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(3-nitrophenyl)methyl]azanium Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-(3-nitrobenzyl)ammonium Formula: C15H26N4O2+2 MolecularWeight: 294.39254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N4O2/c1-17-8-10-18(11-9-17)7-3-6-16-13-14-4-2-5-15(12-14)19(20)21/h2,4-5,12,16H,3,6-11,13H2,1H3/p+2