7,7-dimethyl-7a-prop-1-ynyl-3a,4,5,6-tetrahydro-1,3-benzodioxol-2-one

Systemtic Name: 7,7-dimethyl-7a-prop-1-ynyl-3a,4,5,6-tetrahydro-1,3-benzodioxol-2-one Openeye Name: 7,7-dimethyl-7a-prop-1-ynyl-3a,4,5,6-tetrahydro-1,3-benzodioxol-2-one CAS Name: 7,7-dimethyl-7a-prop-1-ynyl-3a,4,5,6-tetrahydro-1,3-benzodioxol-2-one IUPAC Name: 7,7-dimethyl-7a-prop-1-ynyl-3a,4,5,6-tetrahydro-1,3-benzodioxol-2-one Traditional Name: 7,7-dimethyl-7a-prop-1-ynyl-3a,4,5,6-tetrahydro-1,3-benzodioxol-2-one Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC12C(CCCC1(C)C)OC(=O)O2

Isomeric SMILES

CC#CC12C(CCCC1(C)C)OC(=O)O2

InChI

InChI=1S/C12H16O3/c1-4-7-12-9(14-10(13)15-12)6-5-8-11(12,2)3/h9H,5-6,8H2,1-3H3