O8-methyl O1-propan-2-yl 3-oxidanyloctanedioate

Systemtic Name: O8-methyl O1-propan-2-yl 3-oxidanyloctanedioate Openeye Name: O1-isopropyl O8-methyl 3-hydroxyoctanedioate CAS Name: 3-hydroxyoctanedioic acid O8-methyl ester O1-propan-2-yl ester IUPAC Name: 8-O-methyl 1-O-propan-2-yl 3-hydroxyoctanedioate Traditional Name: 3-hydroxysuberic acid O1-isopropyl ester O8-methyl ester Formula: C12H22O5 MolecularWeight: 246.30008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(CCCCC(=O)OC)O

Isomeric SMILES

CC(C)OC(=O)CC(CCCCC(=O)OC)O

InChI

InChI=1S/C12H22O5/c1-9(2)17-12(15)8-10(13)6-4-5-7-11(14)16-3/h9-10,13H,4-8H2,1-3H3