ethanedioic acid; 2-(3-methylphenoxy)-N-(phenylmethyl)ethanamine

Systemtic Name: ethanedioic acid; 2-(3-methylphenoxy)-N-(phenylmethyl)ethanamine Openeye Name: N-benzyl-2-(3-methylphenoxy)ethanamine; oxalic acid CAS Name: 2-(3-methylphenoxy)-N-(phenylmethyl)ethanamine; oxalic acid IUPAC Name: N-benzyl-2-(3-methylphenoxy)ethanamine; oxalic acid Traditional Name: benzyl-[2-(3-methylphenoxy)ethyl]amine; oxalic acid Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO.C2H2O4/c1-14-6-5-9-16(12-14)18-11-10-17-13-15-7-3-2-4-8-15;3-1(4)2(5)6/h2-9,12,17H,10-11,13H2,1H3;(H,3,4)(H,5,6)