N,N-dimethyl-4-[[(4-methylphenyl)methylamino]methyl]-2-nitro-aniline; ethanedioic acid

Systemtic Name: N,N-dimethyl-4-[[(4-methylphenyl)methylamino]methyl]-2-nitro-aniline; ethanedioic acid Openeye Name: N,N-dimethyl-2-nitro-4-[(p-tolylmethylamino)methyl]aniline; oxalic acid CAS Name: N,N-dimethyl-4-[[(4-methylphenyl)methylamino]methyl]-2-nitroaniline; oxalic acid IUPAC Name: N,N-dimethyl-4-[[(4-methylphenyl)methylamino]methyl]-2-nitroaniline; oxalic acid Traditional Name: dimethyl-[4-[[(4-methylbenzyl)amino]methyl]-2-nitro-phenyl]amine; oxalic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2.C2H2O4/c1-13-4-6-14(7-5-13)11-18-12-15-8-9-16(19(2)3)17(10-15)20(21)22;3-1(4)2(5)6/h4-10,18H,11-12H2,1-3H3;(H,3,4)(H,5,6)