N'-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine; ethanedioic acid

Systemtic Name: N'-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine; ethanedioic acid Openeye Name: N'-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,N-dimethyl-1-phenyl-ethane-1,2-diamine; oxalic acid CAS Name: N'-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-N,N-dimethyl-1-phenylethane-1,2-diamine; oxalic acid IUPAC Name: N'-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N,N-dimethyl-1-phenylethane-1,2-diamine; oxalic acid Traditional Name: [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-1-phenyl-ethyl]-dimethyl-amine; oxalic acid Formula: C26H32N4O8 MolecularWeight: 528.55428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNCC(C3=CC=CC=C3)N(C)C.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNCC(C3=CC=CC=C3)N(C)C.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H28N4.2C2H2O4/c1-17-21(18(2)26(24-17)20-13-9-6-10-14-20)15-23-16-22(25(3)4)19-11-7-5-8-12-19;2*3-1(4)2(5)6/h5-14,22-23H,15-16H2,1-4H3;2*(H,3,4)(H,5,6)