(2-chloranyl-4-fluoranyl-phenyl)methyl 3-oxidanyladamantane-1-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 3-oxidanyladamantane-1-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid (2-chloro-4-fluoro-benzyl) ester Formula: C18H20ClFO3 MolecularWeight: 338.801003

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C18H20ClFO3/c19-15-4-14(20)2-1-13(15)9-23-16(21)17-5-11-3-12(6-17)8-18(22,7-11)10-17/h1-2,4,11-12,22H,3,5-10H2