ethanedioic acid; 2-(3-methoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 2-(3-methoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine Openeye Name: 2-(3-methoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine; oxalic acid CAS Name: 2-(3-methoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(3-methoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine; oxalic acid Traditional Name: 2-(3-methoxyphenyl)ethyl-(4-nitrobenzyl)amine; oxalic acid Formula: C18H20N2O7 MolecularWeight: 376.3606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCNCC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1)CCNCC2=CC=C(C=C2)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C16H18N2O3.C2H2O4/c1-21-16-4-2-3-13(11-16)9-10-17-12-14-5-7-15(8-6-14)18(19)20;3-1(4)2(5)6/h2-8,11,17H,9-10,12H2,1H3;(H,3,4)(H,5,6)