1-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]pyrazole; ethanedioic acid

Systemtic Name: 1-[4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]pyrazole; ethanedioic acid Openeye Name: 1-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]pyrazole; oxalic acid CAS Name: 1-[4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxyphenyl]pyrazole; oxalic acid IUPAC Name: 1-[4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxyphenyl]pyrazole; oxalic acid Traditional Name: 1-[4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]pyrazole; oxalic acid Formula: C24H23ClN4O5 MolecularWeight: 482.91622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)OC(CCC3=CC=C(C=C3)Cl)CN4C=CN=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H21ClN4O.C2H2O4/c23-19-5-2-18(3-6-19)4-9-22(16-26-15-13-24-17-26)28-21-10-7-20(8-11-21)27-14-1-12-25-27;3-1(4)2(5)6/h1-3,5-8,10-15,17,22H,4,9,16H2;(H,3,4)(H,5,6)