ethanedioic acid; 2-(2-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamine

Systemtic Name: ethanedioic acid; 2-(2-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamine Openeye Name: 2-(2-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamine; oxalic acid CAS Name: 2-(2-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(2-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamine; oxalic acid Traditional Name: 2-(2-methoxyphenyl)ethyl-(2,4,5-trimethoxybenzyl)amine; oxalic acid Formula: C21H27NO8 MolecularWeight: 421.44098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNCC2=CC(=C(C=C2OC)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CCNCC2=CC(=C(C=C2OC)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25NO4.C2H2O4/c1-21-16-8-6-5-7-14(16)9-10-20-13-15-11-18(23-3)19(24-4)12-17(15)22-2;3-1(4)2(5)6/h5-8,11-12,20H,9-10,13H2,1-4H3;(H,3,4)(H,5,6)