ethanedioic acid; 1-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethyl]imidazole

Systemtic Name: ethanedioic acid; 1-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethyl]imidazole Openeye Name: 1-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethyl]imidazole; oxalic acid CAS Name: 1-[2-[2-(4-methyl-2-nitrophenoxy)ethoxy]ethyl]imidazole; oxalic acid IUPAC Name: 1-[2-[2-(4-methyl-2-nitrophenoxy)ethoxy]ethyl]imidazole; oxalic acid Traditional Name: 1-[2-[2-(4-methyl-2-nitro-phenoxy)ethoxy]ethyl]imidazole; oxalic acid Formula: C16H19N3O8 MolecularWeight: 381.33736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCOCCN2C=CN=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCOCCN2C=CN=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C14H17N3O4.C2H2O4/c1-12-2-3-14(13(10-12)17(18)19)21-9-8-20-7-6-16-5-4-15-11-16;3-1(4)2(5)6/h2-5,10-11H,6-9H2,1H3;(H,3,4)(H,5,6)