2-[[5-(carboxymethylamino)-2,4-dinitro-phenyl]amino]ethanoic acid

Systemtic Name: 2-[[5-(carboxymethylamino)-2,4-dinitro-phenyl]amino]ethanoic acid Openeye Name: 2-[5-(carboxymethylamino)-2,4-dinitro-anilino]acetic acid CAS Name: 2-[5-(carboxymethylamino)-2,4-dinitroanilino]acetic acid IUPAC Name: 2-[5-(carboxymethylamino)-2,4-dinitroanilino]acetic acid Traditional Name: 2-[5-(carboxymethylamino)-2,4-dinitro-anilino]acetic acid Formula: C10H10N4O8 MolecularWeight: 314.2084

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1NCC(=O)O)[N+](=O)[O-])[N+](=O)[O-])NCC(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1NCC(=O)O)[N+](=O)[O-])[N+](=O)[O-])NCC(=O)O

InChI

InChI=1S/C10H10N4O8/c15-9(16)3-11-5-1-6(12-4-10(17)18)8(14(21)22)2-7(5)13(19)20/h1-2,11-12H,3-4H2,(H,15,16)(H,17,18)