N-[1-(3-bromanylthiophen-2-yl)ethyl]-2-methoxy-5-nitro-aniline

Systemtic Name: N-[1-(3-bromanylthiophen-2-yl)ethyl]-2-methoxy-5-nitro-aniline Openeye Name: N-[1-(3-bromo-2-thienyl)ethyl]-2-methoxy-5-nitro-aniline CAS Name: N-[1-(3-bromo-2-thiophenyl)ethyl]-2-methoxy-5-nitroaniline IUPAC Name: N-[1-(3-bromothiophen-2-yl)ethyl]-2-methoxy-5-nitroaniline Traditional Name: 1-(3-bromo-2-thienyl)ethyl-(2-methoxy-5-nitro-phenyl)amine Formula: C13H13BrN2O3S MolecularWeight: 357.22292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CS1)Br)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C1=C(C=CS1)Br)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C13H13BrN2O3S/c1-8(13-10(14)5-6-20-13)15-11-7-9(16(17)18)3-4-12(11)19-2/h3-8,15H,1-2H3