methyl 3-oxidanylidenecycloheptene-1-carboxylate

Systemtic Name: methyl 3-oxidanylidenecycloheptene-1-carboxylate Openeye Name: methyl 3-oxocycloheptene-1-carboxylate CAS Name: 3-oxo-1-cycloheptenecarboxylic acid methyl ester IUPAC Name: methyl 3-oxocycloheptene-1-carboxylate Traditional Name: 3-ketocycloheptene-1-carboxylic acid methyl ester Formula: C9H12O3 MolecularWeight: 168.18978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)CCCC1

Isomeric SMILES

COC(=O)C1=CC(=O)CCCC1

InChI

InChI=1S/C9H12O3/c1-12-9(11)7-4-2-3-5-8(10)6-7/h6H,2-5H2,1H3