2-(2-tert-butyl-5-methyl-phenoxy)-N-methyl-N-(phenylmethyl)ethanamine; ethanedioic acid

Systemtic Name: 2-(2-tert-butyl-5-methyl-phenoxy)-N-methyl-N-(phenylmethyl)ethanamine; ethanedioic acid Openeye Name: N-benzyl-2-(2-tert-butyl-5-methyl-phenoxy)-N-methyl-ethanamine; oxalic acid CAS Name: 2-(2-tert-butyl-5-methylphenoxy)-N-methyl-N-(phenylmethyl)ethanamine; oxalic acid IUPAC Name: N-benzyl-2-(2-tert-butyl-5-methylphenoxy)-N-methylethanamine; oxalic acid Traditional Name: benzyl-[2-(2-tert-butyl-5-methyl-phenoxy)ethyl]-methyl-amine; oxalic acid Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCCN(C)CC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCCN(C)CC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29NO.C2H2O4/c1-17-11-12-19(21(2,3)4)20(15-17)23-14-13-22(5)16-18-9-7-6-8-10-18;3-1(4)2(5)6/h6-12,15H,13-14,16H2,1-5H3;(H,3,4)(H,5,6)