(2-nitrophenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: (2-nitrophenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: (2-nitrophenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: (2-nitrophenyl)methyl-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: (2-nitrophenyl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: (2-nitrobenzyl)-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C14H23N3O2+2 MolecularWeight: 265.35132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC[NH2+]CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCC[NH2+]CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O2/c18-17(19)14-7-2-1-6-13(14)12-15-8-5-11-16-9-3-4-10-16/h1-2,6-7,15H,3-5,8-12H2/p+2