5-bromanyl-3,4-dinitro-N-phenethyl-thiophen-2-amine

Systemtic Name: 5-bromanyl-3,4-dinitro-N-phenethyl-thiophen-2-amine Openeye Name: 5-bromo-3,4-dinitro-N-phenethyl-thiophen-2-amine CAS Name: 5-bromo-3,4-dinitro-N-phenethyl-2-thiophenamine IUPAC Name: 5-bromo-3,4-dinitro-N-phenethylthiophen-2-amine Traditional Name: (5-bromo-3,4-dinitro-2-thienyl)-phenethyl-amine Formula: C12H10BrN3O4S MolecularWeight: 372.1945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C(C(=C(S2)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C(C(=C(S2)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10BrN3O4S/c13-11-9(15(17)18)10(16(19)20)12(21-11)14-7-6-8-4-2-1-3-5-8/h1-5,14H,6-7H2