naphthalen-1-yl 6-bromanyl-1,5,5-trimethyl-bicyclo[2.1.1]hexane-4-carboxylate

Systemtic Name: naphthalen-1-yl 6-bromanyl-1,5,5-trimethyl-bicyclo[2.1.1]hexane-4-carboxylate Openeye Name: 1-naphthyl 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 1-naphthalenyl ester IUPAC Name: naphthalen-1-yl 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 1-naphthyl ester Formula: C20H21BrO2 MolecularWeight: 373.28354

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C2Br)C(=O)OC3=CC=CC4=CC=CC=C43)C)C

Isomeric SMILES

CC1(C2(CCC1(C2Br)C(=O)OC3=CC=CC4=CC=CC=C43)C)C

InChI

InChI=1S/C20H21BrO2/c1-18(2)19(3)11-12-20(18,16(19)21)17(22)23-15-10-6-8-13-7-4-5-9-14(13)15/h4-10,16H,11-12H2,1-3H3