N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-thiophen-2-yl-ethanamine

Systemtic Name: N-[[2,4-bis(fluoranyl)-5-nitro-phenyl]methyl]-1-thiophen-2-yl-ethanamine Openeye Name: N-[(2,4-difluoro-5-nitro-phenyl)methyl]-1-(2-thienyl)ethanamine CAS Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1-thiophen-2-ylethanamine IUPAC Name: N-[(2,4-difluoro-5-nitrophenyl)methyl]-1-thiophen-2-ylethanamine Traditional Name: (2,4-difluoro-5-nitro-benzyl)-[1-(2-thienyl)ethyl]amine Formula: C13H12F2N2O2S MolecularWeight: 298.308386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CS1)NCC2=CC(=C(C=C2F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12F2N2O2S/c1-8(13-3-2-4-20-13)16-7-9-5-12(17(18)19)11(15)6-10(9)14/h2-6,8,16H,7H2,1H3