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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC1C(=O)CC2(C1(CCC2)C)C

Isomeric SMILES

CC#CCC1C(=O)C[C@]2([C@@]1(CCC2)C)C

InChI

InChI=1S/C14H20O/c1-4-5-7-11-12(15)10-13(2)8-6-9-14(11,13)3/h11H,6-10H2,1-3H3/t11?,13-,14+/m0/s1