[(5R,7S)-4,7-dimethyl-1-oxidanylidene-6,7-dihydro-5H-cyclopenta[c]pyran-5-yl] 4-bromanylbenzoate

Systemtic Name: [(5R,7S)-4,7-dimethyl-1-oxidanylidene-6,7-dihydro-5H-cyclopenta[c]pyran-5-yl] 4-bromanylbenzoate Openeye Name: [(5R,7S)-4,7-dimethyl-1-oxo-6,7-dihydro-5H-cyclopenta[c]pyran-5-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(5R,7S)-4,7-dimethyl-1-oxo-6,7-dihydro-5H-cyclopenta[c]pyran-5-yl] ester IUPAC Name: [(5R,7S)-4,7-dimethyl-1-oxo-6,7-dihydro-5H-cyclopenta[c]pyran-5-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(5R,7S)-1-keto-4,7-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyran-5-yl] ester Formula: C17H15BrO4 MolecularWeight: 363.2026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C1C(=O)OC=C2C)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@H]1C[C@H](C2=C1C(=O)OC=C2C)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrO4/c1-9-7-13(14-10(2)8-21-17(20)15(9)14)22-16(19)11-3-5-12(18)6-4-11/h3-6,8-9,13H,7H2,1-2H3/t9-,13+/m0/s1