3-nitro-N-(2-thiophen-2-ylethyl)pyridin-1-ium-2-amine

Systemtic Name: 3-nitro-N-(2-thiophen-2-ylethyl)pyridin-1-ium-2-amine Openeye Name: 3-nitro-N-[2-(2-thienyl)ethyl]pyridin-1-ium-2-amine CAS Name: 3-nitro-N-(2-thiophen-2-ylethyl)-2-pyridin-1-iumamine IUPAC Name: 3-nitro-N-(2-thiophen-2-ylethyl)pyridin-1-ium-2-amine Traditional Name: (3-nitropyridin-1-ium-2-yl)-[2-(2-thienyl)ethyl]amine Formula: C11H12N3O2S+ MolecularWeight: 250.29688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C([NH+]=C1)NCCC2=CC=CS2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C([NH+]=C1)NCCC2=CC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O2S/c15-14(16)10-4-1-6-12-11(10)13-7-5-9-3-2-8-17-9/h1-4,6,8H,5,7H2,(H,12,13)/p+1