(3aR,6aR)-3a-but-3-ynyl-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one

Systemtic Name: (3aR,6aR)-3a-but-3-ynyl-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one Openeye Name: (3aR,6aR)-3a-but-3-ynyl-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one CAS Name: (3aR,6aR)-3a-but-3-ynyl-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one IUPAC Name: (3aR,6aR)-3a-but-3-ynyl-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one Traditional Name: (3aR,6aR)-3a-but-3-ynyl-3,3-dimethyl-4,5,6,6a-tetrahydro-2H-pentalen-1-one Formula: C14H20O MolecularWeight: 204.308

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2C1(CCC2)CCC#C)C

Isomeric SMILES

CC1(CC(=O)[C@H]2[C@@]1(CCC2)CCC#C)C

InChI

InChI=1S/C14H20O/c1-4-5-8-14-9-6-7-11(14)12(15)10-13(14,2)3/h1,11H,5-10H2,2-3H3/t11-,14-/m0/s1