(3-nitrophenyl)methyl-(2-pyrrolidin-1-ylethyl)azanium

Systemtic Name: (3-nitrophenyl)methyl-(2-pyrrolidin-1-ylethyl)azanium Openeye Name: (3-nitrophenyl)methyl-(2-pyrrolidin-1-ylethyl)ammonium CAS Name: (3-nitrophenyl)methyl-[2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: (3-nitrophenyl)methyl-(2-pyrrolidin-1-ylethyl)azanium Traditional Name: (3-nitrobenzyl)-(2-pyrrolidinoethyl)ammonium Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O2/c17-16(18)13-5-3-4-12(10-13)11-14-6-9-15-7-1-2-8-15/h3-5,10,14H,1-2,6-9,11H2/p+1