N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-phenyl-ethanamine; ethanedioic acid

Systemtic Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-phenyl-ethanamine; ethanedioic acid Openeye Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-phenyl-ethanamine; oxalic acid CAS Name: N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-phenylethanamine; oxalic acid IUPAC Name: N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-2-phenylethanamine; oxalic acid Traditional Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-phenethyl-amine; oxalic acid Formula: C26H24ClN3O4 MolecularWeight: 477.93946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H22ClN3.C2H2O4/c25-22-13-11-20(12-14-22)24-21(17-26-16-15-19-7-3-1-4-8-19)18-28(27-24)23-9-5-2-6-10-23;3-1(4)2(5)6/h1-14,18,26H,15-17H2;(H,3,4)(H,5,6)