N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-nitro-pyridin-2-amine

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-nitro-pyridin-2-amine Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-nitro-pyridin-2-amine CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-nitro-2-pyridinamine IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-3-nitropyridin-2-amine Traditional Name: [(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-(3-nitro-2-pyridyl)amine Formula: C15H19N4O3+ MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC2=C(C=CC=N2)[N+](=O)[O-])C3=CC=CO3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC2=C(C=CC=N2)[N+](=O)[O-])C3=CC=CO3

InChI

InChI=1S/C15H18N4O3/c20-19(21)12-5-3-7-16-15(12)17-11-13(14-6-4-10-22-14)18-8-1-2-9-18/h3-7,10,13H,1-2,8-9,11H2,(H,16,17)/p+1/t13-/m0/s1