methyl 4-oxidanylidene-1,2,3,9-tetrahydrobenzo[7]annulene-3-carboxylate

Systemtic Name: methyl 4-oxidanylidene-1,2,3,9-tetrahydrobenzo[7]annulene-3-carboxylate Openeye Name: methyl 4-oxo-1,2,3,9-tetrahydrobenzo[7]annulene-3-carboxylate CAS Name: 4-oxo-1,2,3,9-tetrahydrobenzo[7]annulene-3-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-1,2,3,9-tetrahydrobenzo[7]annulene-3-carboxylate Traditional Name: 4-keto-1,2,3,9-tetrahydrobenzocycloheptene-3-carboxylic acid methyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C(C1=O)C=CC=CC2

Isomeric SMILES

COC(=O)C1CCC2=C(C1=O)C=CC=CC2

InChI

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