methyl 5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylate

Systemtic Name: methyl 5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylate Openeye Name: methyl 5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylate CAS Name: 5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylate Traditional Name: 5-keto-6,7,8,9-tetrahydrobenzocycloheptene-6-carboxylic acid methyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC2=CC=CC=C2C1=O

Isomeric SMILES

COC(=O)C1CCCC2=CC=CC=C2C1=O

InChI

InChI=1S/C13H14O3/c1-16-13(15)11-8-4-6-9-5-2-3-7-10(9)12(11)14/h2-3,5,7,11H,4,6,8H2,1H3