ethanedioic acid; N-[(4-ethoxyphenyl)methyl]-3-methyl-aniline

Systemtic Name: ethanedioic acid; N-[(4-ethoxyphenyl)methyl]-3-methyl-aniline Openeye Name: N-[(4-ethoxyphenyl)methyl]-3-methyl-aniline; oxalic acid CAS Name: N-[(4-ethoxyphenyl)methyl]-3-methylaniline; oxalic acid IUPAC Name: N-[(4-ethoxyphenyl)methyl]-3-methylaniline; oxalic acid Traditional Name: (4-ethoxybenzyl)-(m-tolyl)amine; oxalic acid Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC2=CC=CC(=C2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC2=CC=CC(=C2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H19NO.C2H2O4/c1-3-18-16-9-7-14(8-10-16)12-17-15-6-4-5-13(2)11-15;3-1(4)2(5)6/h4-11,17H,3,12H2,1-2H3;(H,3,4)(H,5,6)