ethanedioic acid; 5-[3-(4-nitrophenoxy)propyl]-1H-imidazole

Systemtic Name: ethanedioic acid; 5-[3-(4-nitrophenoxy)propyl]-1H-imidazole Openeye Name: 5-[3-(4-nitrophenoxy)propyl]-1H-imidazole; oxalic acid CAS Name: 5-[3-(4-nitrophenoxy)propyl]-1H-imidazole; oxalic acid IUPAC Name: 5-[3-(4-nitrophenoxy)propyl]-1H-imidazole; oxalic acid Traditional Name: 5-[3-(4-nitrophenoxy)propyl]-1H-imidazole; oxalic acid Formula: C14H15N3O7 MolecularWeight: 337.2848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCCCC2=CN=CN2.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCCCC2=CN=CN2.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H13N3O3.C2H2O4/c16-15(17)11-3-5-12(6-4-11)18-7-1-2-10-8-13-9-14-10;3-1(4)2(5)6/h3-6,8-9H,1-2,7H2,(H,13,14);(H,3,4)(H,5,6)