5-bromanyl-3,4-dinitro-N-(phenylmethyl)thiophen-2-amine

Systemtic Name: 5-bromanyl-3,4-dinitro-N-(phenylmethyl)thiophen-2-amine Openeye Name: N-benzyl-5-bromo-3,4-dinitro-thiophen-2-amine CAS Name: 5-bromo-3,4-dinitro-N-(phenylmethyl)-2-thiophenamine IUPAC Name: N-benzyl-5-bromo-3,4-dinitrothiophen-2-amine Traditional Name: benzyl-(5-bromo-3,4-dinitro-2-thienyl)amine Formula: C11H8BrN3O4S MolecularWeight: 358.16792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=C(S2)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=C(S2)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H8BrN3O4S/c12-10-8(14(16)17)9(15(18)19)11(20-10)13-6-7-4-2-1-3-5-7/h1-5,13H,6H2