N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-N-methyl-2-pyridin-2-yl-ethanamine; ethanedioic acid

Systemtic Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-N-methyl-2-pyridin-2-yl-ethanamine; ethanedioic acid Openeye Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-N-methyl-2-(2-pyridyl)ethanamine; oxalic acid CAS Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-N-methyl-2-(2-pyridinyl)ethanamine; oxalic acid IUPAC Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine; oxalic acid Traditional Name: (4,5-dimethoxy-2-nitro-benzyl)-methyl-[2-(2-pyridyl)ethyl]amine; oxalic acid Formula: C19H23N3O8 MolecularWeight: 421.40122

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CCC1=CC=CC=N1)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21N3O4.C2H2O4/c1-19(9-7-14-6-4-5-8-18-14)12-13-10-16(23-2)17(24-3)11-15(13)20(21)22;3-1(4)2(5)6/h4-6,8,10-11H,7,9,12H2,1-3H3;(H,3,4)(H,5,6)