2,4-dinitro-N-[(E)-1-thiophen-2-ylprop-2-ynylideneamino]aniline

Systemtic Name: 2,4-dinitro-N-[(E)-1-thiophen-2-ylprop-2-ynylideneamino]aniline Openeye Name: 2,4-dinitro-N-[(E)-1-(2-thienyl)prop-2-ynylideneamino]aniline CAS Name: 2,4-dinitro-N-[(E)-1-thiophen-2-ylprop-2-ynylideneamino]aniline IUPAC Name: 2,4-dinitro-N-[(E)-1-thiophen-2-ylprop-2-ynylideneamino]aniline Traditional Name: (2,4-dinitrophenyl)-[(E)-1-(2-thienyl)prop-2-ynylideneamino]amine Formula: C13H8N4O4S MolecularWeight: 316.29202

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC=CS2

Isomeric SMILES

C#C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC=CS2

InChI

InChI=1S/C13H8N4O4S/c1-2-10(13-4-3-7-22-13)14-15-11-6-5-9(16(18)19)8-12(11)17(20)21/h1,3-8,15H/b14-10+