N-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(5-bromo-2-thienyl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-(5-bromo-2-thiophenyl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(5-bromothiophen-2-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: [(E)-(5-bromo-2-thienyl)methyleneamino]-(2,4-dinitrophenyl)amine Formula: C11H7BrN4O4S MolecularWeight: 371.16668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NN=CC2=CC=C(S2)Br

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N/N=C/C2=CC=C(S2)Br

InChI

InChI=1S/C11H7BrN4O4S/c12-11-4-2-8(21-11)6-13-14-9-3-1-7(15(17)18)5-10(9)16(19)20/h1-6,14H/b13-6+