methyl (1S,2S)-1-methyl-2-oxidanyl-7-oxidanylidene-cycloheptane-1-carboxylate

Systemtic Name: methyl (1S,2S)-1-methyl-2-oxidanyl-7-oxidanylidene-cycloheptane-1-carboxylate Openeye Name: methyl (1S,2S)-2-hydroxy-1-methyl-7-oxo-cycloheptanecarboxylate CAS Name: (1S,2S)-2-hydroxy-1-methyl-7-oxo-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S)-2-hydroxy-1-methyl-7-oxocycloheptane-1-carboxylate Traditional Name: (1S,2S)-2-hydroxy-7-keto-1-methyl-cycloheptanecarboxylic acid methyl ester Formula: C10H16O4 MolecularWeight: 200.23164

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCCCC1=O)O)C(=O)OC

Isomeric SMILES

C[C@@]1([C@H](CCCCC1=O)O)C(=O)OC

InChI

InChI=1S/C10H16O4/c1-10(9(13)14-2)7(11)5-3-4-6-8(10)12/h7,11H,3-6H2,1-2H3/t7-,10-/m0/s1