ethanedioic acid; 2-phenyl-N-[(3-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)ethanamine

Systemtic Name: ethanedioic acid; 2-phenyl-N-[(3-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)ethanamine Openeye Name: N-benzyl-N-[(3-benzyloxyphenyl)methyl]-2-phenyl-ethanamine; oxalic acid CAS Name: oxalic acid; 2-phenyl-N-[(3-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)ethanamine IUPAC Name: N-benzyl-2-phenyl-N-[(3-phenylmethoxyphenyl)methyl]ethanamine; oxalic acid Traditional Name: (3-benzoxybenzyl)-benzyl-phenethyl-amine; oxalic acid Formula: C31H31NO5 MolecularWeight: 497.58154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)CC3=CC(=CC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)CC3=CC(=CC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C29H29NO.C2H2O4/c1-4-11-25(12-5-1)19-20-30(22-26-13-6-2-7-14-26)23-28-17-10-18-29(21-28)31-24-27-15-8-3-9-16-27;3-1(4)2(5)6/h1-18,21H,19-20,22-24H2;(H,3,4)(H,5,6)