[2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(4-fluoranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: [2-(4-fluoro-3-nitro-anilino)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: [2-(4-fluoro-3-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-(4-fluoro-3-nitroanilino)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [2-(4-fluoro-3-nitro-anilino)-2-keto-ethyl]-(2-thenyl)ammonium Formula: C13H13FN3O3S+ MolecularWeight: 310.324023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C[NH2+]CC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C[NH2+]CC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12FN3O3S/c14-11-4-3-9(6-12(11)17(19)20)16-13(18)8-15-7-10-2-1-5-21-10/h1-6,15H,7-8H2,(H,16,18)/p+1