(1R,3aS,6aS)-1-bromanyl-3a,6a-dimethyl-1,3,4,6-tetrahydropentalene-2,5-dione

Systemtic Name: (1R,3aS,6aS)-1-bromanyl-3a,6a-dimethyl-1,3,4,6-tetrahydropentalene-2,5-dione Openeye Name: (1R,3aS,6aS)-1-bromo-3a,6a-dimethyl-1,3,4,6-tetrahydropentalene-2,5-dione CAS Name: (1R,3aS,6aS)-1-bromo-3a,6a-dimethyl-1,3,4,6-tetrahydropentalene-2,5-dione IUPAC Name: (1R,3aS,6aS)-1-bromo-3a,6a-dimethyl-1,3,4,6-tetrahydropentalene-2,5-dione Traditional Name: (1R,3aS,6aS)-1-bromo-3a,6a-dimethyl-1,3,4,6-tetrahydropentalene-2,5-quinone Formula: C10H13BrO2 MolecularWeight: 245.11302

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(=O)CC1(C(C(=O)C2)Br)C

Isomeric SMILES

C[C@@]12CC(=O)C[C@@]1([C@H](C(=O)C2)Br)C

InChI

InChI=1S/C10H13BrO2/c1-9-3-6(12)4-10(9,2)8(11)7(13)5-9/h8H,3-5H2,1-2H3/t8-,9-,10+/m0/s1