spiro[4H-isochromene-1,1'-cyclohexane]-3-one

Systemtic Name: spiro[4H-isochromene-1,1'-cyclohexane]-3-one Openeye Name: spiro[cyclohexane-1,1'-isochromane]-3'-one CAS Name: 3-spiro[3,4-dihydro-1H-2-benzopyran-1,1'-cyclohexane]one IUPAC Name: spiro[4H-isochromene-1,1'-cyclohexane]-3-one Traditional Name: spiro[cyclohexane-1,1'-isochroman]-3'-one Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3=CC=CC=C3CC(=O)O2

Isomeric SMILES

C1CCC2(CC1)C3=CC=CC=C3CC(=O)O2

InChI

InChI=1S/C14H16O2/c15-13-10-11-6-2-3-7-12(11)14(16-13)8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-10H2