(4-bromanyl-2-chloranyl-6-methyl-phenyl) adamantane-1-carboxylate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) adamantane-1-carboxylate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C18H20BrClO2 MolecularWeight: 383.7072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C23CC4CC(C2)CC(C4)C3)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C23CC4CC(C2)CC(C4)C3)Cl)Br

InChI

InChI=1S/C18H20BrClO2/c1-10-2-14(19)6-15(20)16(10)22-17(21)18-7-11-3-12(8-18)5-13(4-11)9-18/h2,6,11-13H,3-5,7-9H2,1H3