dimethyl 2-[(2-oxidanylidenecycloheptyl)methyl]propanedioate

Systemtic Name: dimethyl 2-[(2-oxidanylidenecycloheptyl)methyl]propanedioate Openeye Name: dimethyl 2-[(2-oxocycloheptyl)methyl]propanedioate CAS Name: 2-[(2-oxocycloheptyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-oxocycloheptyl)methyl]propanedioate Traditional Name: 2-[(2-ketocycloheptyl)methyl]malonic acid dimethyl ester Formula: C13H20O5 MolecularWeight: 256.2949

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCCCCC1=O)C(=O)OC

Isomeric SMILES

COC(=O)C(CC1CCCCCC1=O)C(=O)OC

InChI

InChI=1S/C13H20O5/c1-17-12(15)10(13(16)18-2)8-9-6-4-3-5-7-11(9)14/h9-10H,3-8H2,1-2H3