(5-chloranyl-8-oxidanyl-quinolin-7-yl)-[3-(imidazol-1-ylmethyl)-5-(phenylmethyl)phenyl]methanone

Systemtic Name: (5-chloranyl-8-oxidanyl-quinolin-7-yl)-[3-(imidazol-1-ylmethyl)-5-(phenylmethyl)phenyl]methanone Openeye Name: [3-benzyl-5-(imidazol-1-ylmethyl)phenyl]-(5-chloro-8-hydroxy-7-quinolyl)methanone CAS Name: (5-chloro-8-hydroxy-7-quinolinyl)-[3-(1-imidazolylmethyl)-5-(phenylmethyl)phenyl]methanone IUPAC Name: [3-benzyl-5-(imidazol-1-ylmethyl)phenyl]-(5-chloro-8-hydroxyquinolin-7-yl)methanone Traditional Name: [3-benzyl-5-(imidazol-1-ylmethyl)phenyl]-(5-chloro-8-hydroxy-7-quinolyl)methanone Formula: C27H20ClN3O2 MolecularWeight: 453.9196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)C3=CC(=C4C=CC=NC4=C3O)Cl)CN5C=CN=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CC(=C2)C(=O)C3=CC(=C4C=CC=NC4=C3O)Cl)CN5C=CN=C5

InChI

InChI=1S/C27H20ClN3O2/c28-24-15-23(27(33)25-22(24)7-4-8-30-25)26(32)21-13-19(11-18-5-2-1-3-6-18)12-20(14-21)16-31-10-9-29-17-31/h1-10,12-15,17,33H,11,16H2