4-(carboxymethylamino)-3,5-dinitro-benzoic acid

Systemtic Name: 4-(carboxymethylamino)-3,5-dinitro-benzoic acid Openeye Name: 4-(carboxymethylamino)-3,5-dinitro-benzoic acid CAS Name: 4-(carboxymethylamino)-3,5-dinitrobenzoic acid IUPAC Name: 4-(carboxymethylamino)-3,5-dinitrobenzoic acid Traditional Name: 4-(carboxymethylamino)-3,5-dinitro-benzoic acid Formula: C9H7N3O8 MolecularWeight: 285.16718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7N3O8/c13-7(14)3-10-8-5(11(17)18)1-4(9(15)16)2-6(8)12(19)20/h1-2,10H,3H2,(H,13,14)(H,15,16)