2-(4-tert-butylphenoxy)-N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(3-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(3-fluorophenyl)methyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(5-chloro-8-hydroxy-7-quinolyl)-(3-fluorophenyl)methyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[(5-chloro-8-hydroxy-7-quinolinyl)-(3-fluorophenyl)methyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(5-chloro-8-hydroxyquinolin-7-yl)-(3-fluorophenyl)methyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(5-chloro-8-hydroxy-7-quinolyl)-(3-fluorophenyl)methyl]acetamide Formula: C28H26ClFN2O3 MolecularWeight: 492.969043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(C2=CC(=CC=C2)F)C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(C2=CC(=CC=C2)F)C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C28H26ClFN2O3/c1-28(2,3)18-9-11-20(12-10-18)35-16-24(33)32-25(17-6-4-7-19(30)14-17)22-15-23(29)21-8-5-13-31-26(21)27(22)34/h4-15,25,34H,16H2,1-3H3,(H,32,33)