2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cycloheptane-1,3-dione

Systemtic Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cycloheptane-1,3-dione Openeye Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cycloheptane-1,3-dione CAS Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cycloheptane-1,3-dione IUPAC Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cycloheptane-1,3-dione Traditional Name: 2-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]cycloheptane-1,3-quinone Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CC2C(=O)CCCCC2=O)C

Isomeric SMILES

CC1(OC[C@@H](O1)CC2C(=O)CCCCC2=O)C

InChI

InChI=1S/C13H20O4/c1-13(2)16-8-9(17-13)7-10-11(14)5-3-4-6-12(10)15/h9-10H,3-8H2,1-2H3/t9-/m0/s1