(2-bromanyl-4-methanoyl-6-methoxy-phenyl) adamantane-1-carboxylate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) adamantane-1-carboxylate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C19H21BrO4 MolecularWeight: 393.27164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H21BrO4/c1-23-16-6-14(10-21)5-15(20)17(16)24-18(22)19-7-11-2-12(8-19)4-13(3-11)9-19/h5-6,10-13H,2-4,7-9H2,1H3