ethanedioic acid; N-(phenylmethyl)-2-[4-(2-phenylpropan-2-yl)phenoxy]ethanamine

Systemtic Name: ethanedioic acid; N-(phenylmethyl)-2-[4-(2-phenylpropan-2-yl)phenoxy]ethanamine Openeye Name: N-benzyl-2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]ethanamine; oxalic acid CAS Name: oxalic acid; N-(phenylmethyl)-2-[4-(2-phenylpropan-2-yl)phenoxy]ethanamine IUPAC Name: N-benzyl-2-[4-(2-phenylpropan-2-yl)phenoxy]ethanamine; oxalic acid Traditional Name: benzyl-[2-(4-cumylphenoxy)ethyl]amine; oxalic acid Formula: C26H29NO5 MolecularWeight: 435.51216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCCNCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCCNCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H27NO.C2H2O4/c1-24(2,21-11-7-4-8-12-21)22-13-15-23(16-14-22)26-18-17-25-19-20-9-5-3-6-10-20;3-1(4)2(5)6/h3-16,25H,17-19H2,1-2H3;(H,3,4)(H,5,6)