2-[[(2-tert-butylphenyl)-phenyl-methoxy]methyl]-1,4-dimethyl-piperazine; ethanedioic acid

Systemtic Name: 2-[[(2-tert-butylphenyl)-phenyl-methoxy]methyl]-1,4-dimethyl-piperazine; ethanedioic acid Openeye Name: 2-[[(2-tert-butylphenyl)-phenyl-methoxy]methyl]-1,4-dimethyl-piperazine; oxalic acid CAS Name: 2-[[(2-tert-butylphenyl)-phenylmethoxy]methyl]-1,4-dimethylpiperazine; oxalic acid IUPAC Name: 2-[[(2-tert-butylphenyl)-phenylmethoxy]methyl]-1,4-dimethylpiperazine; oxalic acid Traditional Name: 2-[[(2-tert-butylphenyl)-phenyl-methoxy]methyl]-1,4-dimethyl-piperazine; oxalic acid Formula: C28H38N2O9 MolecularWeight: 546.60932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1C(C2=CC=CC=C2)OCC3CN(CCN3C)C.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1C(C2=CC=CC=C2)OCC3CN(CCN3C)C.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H34N2O.2C2H2O4/c1-24(2,3)22-14-10-9-13-21(22)23(19-11-7-6-8-12-19)27-18-20-17-25(4)15-16-26(20)5;2*3-1(4)2(5)6/h6-14,20,23H,15-18H2,1-5H3;2*(H,3,4)(H,5,6)