N-[1-(3-bromanylthiophen-2-yl)ethyl]-4-methyl-3-nitro-aniline

Systemtic Name: N-[1-(3-bromanylthiophen-2-yl)ethyl]-4-methyl-3-nitro-aniline Openeye Name: N-[1-(3-bromo-2-thienyl)ethyl]-4-methyl-3-nitro-aniline CAS Name: N-[1-(3-bromo-2-thiophenyl)ethyl]-4-methyl-3-nitroaniline IUPAC Name: N-[1-(3-bromothiophen-2-yl)ethyl]-4-methyl-3-nitroaniline Traditional Name: 1-(3-bromo-2-thienyl)ethyl-(4-methyl-3-nitro-phenyl)amine Formula: C13H13BrN2O2S MolecularWeight: 341.22352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(C)C2=C(C=CS2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(C)C2=C(C=CS2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H13BrN2O2S/c1-8-3-4-10(7-12(8)16(17)18)15-9(2)13-11(14)5-6-19-13/h3-7,9,15H,1-2H3