ethanedioic acid; 1-(4-methylphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine

Systemtic Name: ethanedioic acid; 1-(4-methylphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine Openeye Name: oxalic acid; 1-(p-tolyl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine CAS Name: 1-(4-methylphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine; oxalic acid IUPAC Name: 1-(4-methylphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine; oxalic acid Traditional Name: (4-methylbenzyl)-(3,4,5-trimethoxybenzyl)amine; oxalic acid Formula: C20H25NO7 MolecularWeight: 391.415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNCC2=CC(=C(C(=C2)OC)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNCC2=CC(=C(C(=C2)OC)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23NO3.C2H2O4/c1-13-5-7-14(8-6-13)11-19-12-15-9-16(20-2)18(22-4)17(10-15)21-3;3-1(4)2(5)6/h5-10,19H,11-12H2,1-4H3;(H,3,4)(H,5,6)