ethanedioic acid; 1-methyl-5-(3-nitrophenyl)-N-[(3-nitrophenyl)methyl]imidazol-2-amine

Systemtic Name: ethanedioic acid; 1-methyl-5-(3-nitrophenyl)-N-[(3-nitrophenyl)methyl]imidazol-2-amine Openeye Name: 1-methyl-5-(3-nitrophenyl)-N-[(3-nitrophenyl)methyl]imidazol-2-amine; oxalic acid CAS Name: 1-methyl-5-(3-nitrophenyl)-N-[(3-nitrophenyl)methyl]-2-imidazolamine; oxalic acid IUPAC Name: 1-methyl-5-(3-nitrophenyl)-N-[(3-nitrophenyl)methyl]imidazol-2-amine; oxalic acid Traditional Name: [1-methyl-5-(3-nitrophenyl)imidazol-2-yl]-(3-nitrobenzyl)amine; oxalic acid Formula: C19H17N5O8 MolecularWeight: 443.36698

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1NCC2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=CC=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CN1C(=CN=C1NCC2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=CC=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C17H15N5O4.C2H2O4/c1-20-16(13-5-3-7-15(9-13)22(25)26)11-19-17(20)18-10-12-4-2-6-14(8-12)21(23)24;3-1(4)2(5)6/h2-9,11H,10H2,1H3,(H,18,19);(H,3,4)(H,5,6)