2-adamantyl 4-bromanylbenzoate

Systemtic Name: 2-adamantyl 4-bromanylbenzoate Openeye Name: 2-adamantyl 4-bromobenzoate CAS Name: 4-bromobenzoic acid 2-adamantyl ester IUPAC Name: 2-adamantyl 4-bromobenzoate Traditional Name: 4-bromobenzoic acid 2-adamantyl ester Formula: C17H19BrO2 MolecularWeight: 335.23556

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)C3OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H19BrO2/c18-15-3-1-12(2-4-15)17(19)20-16-13-6-10-5-11(8-13)9-14(16)7-10/h1-4,10-11,13-14,16H,5-9H2