(6aR,10aR)-3-hept-1-ynyl-6,6-dimethyl-1-oxidanyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one

Systemtic Name: (6aR,10aR)-3-hept-1-ynyl-6,6-dimethyl-1-oxidanyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one Openeye Name: (6aR,10aR)-3-hept-1-ynyl-1-hydroxy-6,6-dimethyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one CAS Name: (6aR,10aR)-3-hept-1-ynyl-1-hydroxy-6,6-dimethyl-7,8,10,10a-tetrahydro-6aH-benzo[c][1]benzopyran-9-one IUPAC Name: (6aR,10aR)-3-hept-1-ynyl-1-hydroxy-6,6-dimethyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one Traditional Name: (6aR,10aR)-3-hept-1-ynyl-1-hydroxy-6,6-dimethyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-9-one Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=CC2=C(C3CC(=O)CCC3C(O2)(C)C)C(=C1)O

Isomeric SMILES

CCCCCC#CC1=CC2=C([C@@H]3CC(=O)CC[C@H]3C(O2)(C)C)C(=C1)O

InChI

InChI=1S/C22H28O3/c1-4-5-6-7-8-9-15-12-19(24)21-17-14-16(23)10-11-18(17)22(2,3)25-20(21)13-15/h12-13,17-18,24H,4-7,10-11,14H2,1-3H3/t17-,18-/m1/s1