2-[(3,5-dinitrothiophen-2-yl)amino]ethanoic acid

Systemtic Name: 2-[(3,5-dinitrothiophen-2-yl)amino]ethanoic acid Openeye Name: 2-[(3,5-dinitro-2-thienyl)amino]acetic acid CAS Name: 2-[(3,5-dinitro-2-thiophenyl)amino]acetic acid IUPAC Name: 2-[(3,5-dinitrothiophen-2-yl)amino]acetic acid Traditional Name: 2-[(3,5-dinitro-2-thienyl)amino]acetic acid Formula: C6H5N3O6S MolecularWeight: 247.1854

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1[N+](=O)[O-])NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=C1[N+](=O)[O-])NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C6H5N3O6S/c10-5(11)2-7-6-3(8(12)13)1-4(16-6)9(14)15/h1,7H,2H2,(H,10,11)