5-[(4S,5R)-2,2-dimethyl-5-prop-1-ynyl-1,3-dioxolan-4-yl]pent-1-en-3-one

Systemtic Name: 5-[(4S,5R)-2,2-dimethyl-5-prop-1-ynyl-1,3-dioxolan-4-yl]pent-1-en-3-one Openeye Name: 5-[(4S,5R)-2,2-dimethyl-5-prop-1-ynyl-1,3-dioxolan-4-yl]pent-1-en-3-one CAS Name: 5-[(4S,5R)-2,2-dimethyl-5-prop-1-ynyl-1,3-dioxolan-4-yl]-1-penten-3-one IUPAC Name: 5-[(4S,5R)-2,2-dimethyl-5-prop-1-ynyl-1,3-dioxolan-4-yl]pent-1-en-3-one Traditional Name: 5-[(4S,5R)-2,2-dimethyl-5-prop-1-ynyl-1,3-dioxolan-4-yl]pent-1-en-3-one Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1C(OC(O1)(C)C)CCC(=O)C=C

Isomeric SMILES

CC#C[C@@H]1[C@@H](OC(O1)(C)C)CCC(=O)C=C

InChI

InChI=1S/C13H18O3/c1-5-7-11-12(9-8-10(14)6-2)16-13(3,4)15-11/h6,11-12H,2,8-9H2,1,3-4H3/t11-,12+/m1/s1