(1S,3aS)-1-but-3-enyl-5,5-dimethyl-1,3,3a,4,6,6a-hexahydropentalen-2-one

Systemtic Name: (1S,3aS)-1-but-3-enyl-5,5-dimethyl-1,3,3a,4,6,6a-hexahydropentalen-2-one Openeye Name: (1S,3aS)-1-but-3-enyl-5,5-dimethyl-1,3,3a,4,6,6a-hexahydropentalen-2-one CAS Name: (1S,3aS)-1-but-3-enyl-5,5-dimethyl-1,3,3a,4,6,6a-hexahydropentalen-2-one IUPAC Name: (1S,3aS)-1-but-3-enyl-5,5-dimethyl-1,3,3a,4,6,6a-hexahydropentalen-2-one Traditional Name: (1S,3aS)-1-but-3-enyl-5,5-dimethyl-1,3,3a,4,6,6a-hexahydropentalen-2-one Formula: C14H22O MolecularWeight: 206.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(=O)C(C2C1)CCC=C)C

Isomeric SMILES

CC1(C[C@H]2CC(=O)[C@H](C2C1)CCC=C)C

InChI

InChI=1S/C14H22O/c1-4-5-6-11-12-9-14(2,3)8-10(12)7-13(11)15/h4,10-12H,1,5-9H2,2-3H3/t10-,11+,12?/m1/s1