N-[(2,3-dimethoxyphenyl)methyl]-1-(4-nitrophenyl)methanamine; ethanedioic acid

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-nitrophenyl)methanamine; ethanedioic acid Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-nitrophenyl)methanamine; oxalic acid CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-nitrophenyl)methanamine; oxalic acid IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-1-(4-nitrophenyl)methanamine; oxalic acid Traditional Name: (4-nitrobenzyl)-o-veratryl-amine; oxalic acid Formula: C18H20N2O8 MolecularWeight: 392.36

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CNCC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)CNCC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C16H18N2O4.C2H2O4/c1-21-15-5-3-4-13(16(15)22-2)11-17-10-12-6-8-14(9-7-12)18(19)20;3-1(4)2(5)6/h3-9,17H,10-11H2,1-2H3;(H,3,4)(H,5,6)