1-[5-[[2-(4-chlorophenyl)-1,3-benzoxazol-6-yl]oxy]-2-oxidanyl-pentyl]imidazole-4-carboxamide

Systemtic Name: 1-[5-[[2-(4-chlorophenyl)-1,3-benzoxazol-6-yl]oxy]-2-oxidanyl-pentyl]imidazole-4-carboxamide Openeye Name: 1-[5-[[2-(4-chlorophenyl)-1,3-benzoxazol-6-yl]oxy]-2-hydroxy-pentyl]imidazole-4-carboxamide CAS Name: 1-[5-[[2-(4-chlorophenyl)-1,3-benzoxazol-6-yl]oxy]-2-hydroxypentyl]-4-imidazolecarboxamide IUPAC Name: 1-[5-[[2-(4-chlorophenyl)-1,3-benzoxazol-6-yl]oxy]-2-hydroxypentyl]imidazole-4-carboxamide Traditional Name: 1-[5-[[2-(4-chlorophenyl)-1,3-benzoxazol-6-yl]oxy]-2-hydroxy-pentyl]imidazole-4-carboxamide Formula: C22H21ClN4O4 MolecularWeight: 440.87954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(O2)C=C(C=C3)OCCCC(CN4C=C(N=C4)C(=O)N)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(O2)C=C(C=C3)OCCCC(CN4C=C(N=C4)C(=O)N)O)Cl

InChI

InChI=1S/C22H21ClN4O4/c23-15-5-3-14(4-6-15)22-26-18-8-7-17(10-20(18)31-22)30-9-1-2-16(28)11-27-12-19(21(24)29)25-13-27/h3-8,10,12-13,16,28H,1-2,9,11H2,(H2,24,29)