[(1S,4R,5S,7S)-5-bromanyl-1,4-dimethyl-2,3-diphenyl-7-bicyclo[2.2.1]hept-2-enyl] ethanoate

Systemtic Name: [(1S,4R,5S,7S)-5-bromanyl-1,4-dimethyl-2,3-diphenyl-7-bicyclo[2.2.1]hept-2-enyl] ethanoate Openeye Name: [(1S,4R,5S,7S)-5-bromo-1,4-dimethyl-2,3-diphenyl-7-bicyclo[2.2.1]hept-2-enyl] acetate CAS Name: acetic acid [(1S,4R,5S,7S)-5-bromo-1,4-dimethyl-2,3-diphenyl-7-bicyclo[2.2.1]hept-2-enyl] ester IUPAC Name: [(1S,4R,5S,7S)-5-bromo-1,4-dimethyl-2,3-diphenyl-7-bicyclo[2.2.1]hept-2-enyl] acetate Traditional Name: acetic acid [(1S,4R,5S,7S)-5-bromo-1,4-dimethyl-2,3-diphenyl-7-bicyclo[2.2.1]hept-2-enyl] ester Formula: C23H23BrO2 MolecularWeight: 411.33152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2(CC(C1(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C)Br)C

Isomeric SMILES

CC(=O)O[C@H]1[C@]2(C[C@@H]([C@@]1(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C)Br)C

InChI

InChI=1S/C23H23BrO2/c1-15(25)26-21-22(2)14-18(24)23(21,3)20(17-12-8-5-9-13-17)19(22)16-10-6-4-7-11-16/h4-13,18,21H,14H2,1-3H3/t18-,21-,22-,23+/m0/s1