ethanedioic acid; 1-(4-methylphenyl)-N-[(2-nitrophenyl)methyl]methanamine

Systemtic Name: ethanedioic acid; 1-(4-methylphenyl)-N-[(2-nitrophenyl)methyl]methanamine Openeye Name: N-[(2-nitrophenyl)methyl]-1-(p-tolyl)methanamine; oxalic acid CAS Name: 1-(4-methylphenyl)-N-[(2-nitrophenyl)methyl]methanamine; oxalic acid IUPAC Name: 1-(4-methylphenyl)-N-[(2-nitrophenyl)methyl]methanamine; oxalic acid Traditional Name: (4-methylbenzyl)-(2-nitrobenzyl)amine; oxalic acid Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNCC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNCC2=CC=CC=C2[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C15H16N2O2.C2H2O4/c1-12-6-8-13(9-7-12)10-16-11-14-4-2-3-5-15(14)17(18)19;3-1(4)2(5)6/h2-9,16H,10-11H2,1H3;(H,3,4)(H,5,6)