(2-bromanyl-4-methanoyl-6-methoxy-phenyl) 2-(3-bromanyl-1-adamantyl)ethanoate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) 2-(3-bromanyl-1-adamantyl)ethanoate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) 2-(3-bromo-1-adamantyl)acetate CAS Name: 2-(3-bromo-1-adamantyl)acetic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) 2-(3-bromo-1-adamantyl)acetate Traditional Name: 2-(3-bromo-1-adamantyl)acetic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C20H22Br2O4 MolecularWeight: 486.19428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C20H22Br2O4/c1-25-16-4-12(10-23)3-15(21)18(16)26-17(24)9-19-5-13-2-14(6-19)8-20(22,7-13)11-19/h3-4,10,13-14H,2,5-9,11H2,1H3