N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3,5-dimethyl-aniline; ethanedioic acid

Systemtic Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3,5-dimethyl-aniline; ethanedioic acid Openeye Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3,5-dimethyl-aniline; oxalic acid CAS Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3,5-dimethylaniline; oxalic acid IUPAC Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3,5-dimethylaniline; oxalic acid Traditional Name: (4,5-dimethoxy-2-nitro-benzyl)-(3,5-dimethylphenyl)amine; oxalic acid Formula: C19H22N2O8 MolecularWeight: 406.38658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC(=C1)NCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H20N2O4.C2H2O4/c1-11-5-12(2)7-14(6-11)18-10-13-8-16(22-3)17(23-4)9-15(13)19(20)21;3-1(4)2(5)6/h5-9,18H,10H2,1-4H3;(H,3,4)(H,5,6)