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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H22ClN3.C2H2O4/c1-18(19-8-4-2-5-9-19)26-16-21-17-28(23-10-6-3-7-11-23)27-24(21)20-12-14-22(25)15-13-20;3-1(4)2(5)6/h2-15,17-18,26H,16H2,1H3;(H,3,4)(H,5,6)