(3R,3'R,3aR,7aS)-3'-ethenyl-1'-methanoyl-3',7,7-trimethyl-1-oxidanylidene-spiro[4,5,6,7a-tetrahydro-2-benzofuran-3,6'-cyclohexene]-3a-carboxylic acid

Systemtic Name: (3R,3'R,3aR,7aS)-3'-ethenyl-1'-methanoyl-3',7,7-trimethyl-1-oxidanylidene-spiro[4,5,6,7a-tetrahydro-2-benzofuran-3,6'-cyclohexene]-3a-carboxylic acid Openeye Name: (3R,3'R,3aR,7aS)-1'-formyl-3',7,7-trimethyl-1-oxo-3'-vinyl-spiro[4,5,6,7a-tetrahydroisobenzofuran-3,6'-cyclohexene]-3a-carboxylic acid CAS Name: (3R,3'R,3aR,7aS)-3'-ethenyl-1'-formyl-3',7,7-trimethyl-1-oxo-3a-spiro[4,5,6,7a-tetrahydroisobenzofuran-3,6'-cyclohexene]carboxylic acid IUPAC Name: (3R,3'R,3aR,7aS)-3'-ethenyl-1'-formyl-3',7,7-trimethyl-1-oxospiro[4,5,6,7a-tetrahydro-2-benzofuran-3,6'-cyclohexene]-3a-carboxylic acid Traditional Name: (3R,3'R,3aR,7aS)-1'-formyl-1-keto-3',7,7-trimethyl-3'-vinyl-spiro[4,5,6,7a-tetrahydroisobenzofuran-3,6'-cyclohexene]-3a-carboxylic acid Formula: C20H26O5 MolecularWeight: 346.41744

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1C(=O)OC23CCC(C=C3C=O)(C)C=C)C(=O)O)C

Isomeric SMILES

C[C@@]1(CC[C@@]2(C(=C1)C=O)[C@]3(CCCC([C@@H]3C(=O)O2)(C)C)C(=O)O)C=C

InChI

InChI=1S/C20H26O5/c1-5-18(4)9-10-20(13(11-18)12-21)19(16(23)24)8-6-7-17(2,3)14(19)15(22)25-20/h5,11-12,14H,1,6-10H2,2-4H3,(H,23,24)/t14-,18-,19-,20+/m0/s1