(4-methoxycarbonylphenyl) 6-bromanyl-1,5,5-trimethyl-bicyclo[2.1.1]hexane-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 6-bromanyl-1,5,5-trimethyl-bicyclo[2.1.1]hexane-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 6-bromo-1,5,5-trimethyl-bicyclo[2.1.1]hexane-4-carboxylate CAS Name: 6-bromo-1,5,5-trimethyl-4-bicyclo[2.1.1]hexanecarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 6-bromo-1,5,5-trimethylbicyclo[2.1.1]hexane-4-carboxylate Traditional Name: 6-bromo-1,5,5-trimethyl-bicyclo[2.1.1]hexane-4-carboxylic acid (4-carbomethoxyphenyl) ester Formula: C18H21BrO4 MolecularWeight: 381.26094

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C2Br)C(=O)OC3=CC=C(C=C3)C(=O)OC)C)C

Isomeric SMILES

CC1(C2(CCC1(C2Br)C(=O)OC3=CC=C(C=C3)C(=O)OC)C)C

InChI

InChI=1S/C18H21BrO4/c1-16(2)17(3)9-10-18(16,14(17)19)15(21)23-12-7-5-11(6-8-12)13(20)22-4/h5-8,14H,9-10H2,1-4H3