ethanedioic acid; N-(phenylmethyl)-2-(2,3,5-trimethylphenoxy)ethanamine

Systemtic Name: ethanedioic acid; N-(phenylmethyl)-2-(2,3,5-trimethylphenoxy)ethanamine Openeye Name: N-benzyl-2-(2,3,5-trimethylphenoxy)ethanamine; oxalic acid CAS Name: oxalic acid; N-(phenylmethyl)-2-(2,3,5-trimethylphenoxy)ethanamine IUPAC Name: N-benzyl-2-(2,3,5-trimethylphenoxy)ethanamine; oxalic acid Traditional Name: benzyl-[2-(2,3,5-trimethylphenoxy)ethyl]amine; oxalic acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCNCC2=CC=CC=C2)C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCNCC2=CC=CC=C2)C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23NO.C2H2O4/c1-14-11-15(2)16(3)18(12-14)20-10-9-19-13-17-7-5-4-6-8-17;3-1(4)2(5)6/h4-8,11-12,19H,9-10,13H2,1-3H3;(H,3,4)(H,5,6)