N-[3-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]ethanamide; ethanedioic acid

Systemtic Name: N-[3-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxyphenyl]ethanamide; ethanedioic acid Openeye Name: N-[3-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]acetamide; oxalic acid CAS Name: N-[3-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxyphenyl]acetamide; oxalic acid IUPAC Name: N-[3-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxyphenyl]acetamide; oxalic acid Traditional Name: N-[3-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]phenyl]acetamide; oxalic acid Formula: C23H24ClN3O6 MolecularWeight: 473.90616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H22ClN3O2.C2H2O4/c1-16(26)24-19-3-2-4-20(13-19)27-21(14-25-12-11-23-15-25)10-7-17-5-8-18(22)9-6-17;3-1(4)2(5)6/h2-6,8-9,11-13,15,21H,7,10,14H2,1H3,(H,24,26);(H,3,4)(H,5,6)