N-[(5-bromanylthiophen-3-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(5-bromanylthiophen-3-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[(5-bromo-3-thienyl)methyl]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[(5-bromo-3-thiophenyl)methyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(5-bromothiophen-3-yl)methyl]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: (5-bromo-3-thienyl)methyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C12H8BrF3N2O2S MolecularWeight: 381.16833

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCC2=CSC(=C2)Br

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCC2=CSC(=C2)Br

InChI

InChI=1S/C12H8BrF3N2O2S/c13-11-3-7(6-21-11)5-17-9-2-1-8(12(14,15)16)4-10(9)18(19)20/h1-4,6,17H,5H2