tert-butyl (3R)-8-oxidanylidene-9-propan-2-ylidene-3-prop-1-en-2-yl-13-oxabicyclo[8.2.1]trideca-1(12),10-dien-6-yne-12-carboxylate

Systemtic Name: tert-butyl (3R)-8-oxidanylidene-9-propan-2-ylidene-3-prop-1-en-2-yl-13-oxabicyclo[8.2.1]trideca-1(12),10-dien-6-yne-12-carboxylate Openeye Name: tert-butyl (3R)-3-isopropenyl-9-isopropylidene-8-oxo-13-oxabicyclo[8.2.1]trideca-1(12),10-dien-6-yne-12-carboxylate CAS Name: (3R)-3-(1-methylethenyl)-8-oxo-9-propan-2-ylidene-13-oxabicyclo[8.2.1]trideca-1(12),10-dien-6-yne-12-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-8-oxo-9-propan-2-ylidene-3-prop-1-en-2-yl-13-oxabicyclo[8.2.1]trideca-1(12),10-dien-6-yne-12-carboxylate Traditional Name: (3R)-3-isopropenyl-9-isopropylidene-8-keto-13-oxabicyclo[8.2.1]trideca-1(12),10-dien-6-yne-12-carboxylic acid tert-butyl ester Formula: C23H28O4 MolecularWeight: 368.46602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2=CC(=C(O2)CC(CCC#CC1=O)C(=C)C)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC(=C1C2=CC(=C(O2)C[C@@H](CCC#CC1=O)C(=C)C)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C23H28O4/c1-14(2)16-10-8-9-11-18(24)21(15(3)4)20-13-17(19(12-16)26-20)22(25)27-23(5,6)7/h13,16H,1,8,10,12H2,2-7H3/t16-/m1/s1