dimethyl-[3-[(3-nitrophenyl)methylazaniumyl]propyl]azanium

Systemtic Name: dimethyl-[3-[(3-nitrophenyl)methylazaniumyl]propyl]azanium Openeye Name: dimethyl-[3-[(3-nitrophenyl)methylammonio]propyl]ammonium CAS Name: dimethyl-[3-[(3-nitrophenyl)methylammonio]propyl]ammonium IUPAC Name: dimethyl-[3-[(3-nitrophenyl)methylazaniumyl]propyl]azanium Traditional Name: dimethyl-[3-[(3-nitrobenzyl)ammonio]propyl]ammonium Formula: C12H21N3O2+2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O2/c1-14(2)8-4-7-13-10-11-5-3-6-12(9-11)15(16)17/h3,5-6,9,13H,4,7-8,10H2,1-2H3/p+2