(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl 2-chloranyl-6-fluoranyl-benzoate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C22H23ClFN3O5S MolecularWeight: 495.951523

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H23ClFN3O5S/c1-2-8-27-19-7-6-15(33(29,30)26-9-11-31-12-10-26)13-18(19)25-20(27)14-32-22(28)21-16(23)4-3-5-17(21)24/h3-7,13H,2,8-12,14H2,1H3