diethyl 5-oxidanylidene-1,3,3a,4-tetrahydrobenzo[f]azulene-2,2-dicarboxylate

Systemtic Name: diethyl 5-oxidanylidene-1,3,3a,4-tetrahydrobenzo[f]azulene-2,2-dicarboxylate Openeye Name: diethyl 5-oxo-1,3,3a,4-tetrahydrobenzo[f]azulene-2,2-dicarboxylate CAS Name: 5-oxo-1,3,3a,4-tetrahydrobenzo[f]azulene-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-oxo-1,3,3a,4-tetrahydrobenzo[f]azulene-2,2-dicarboxylate Traditional Name: 5-keto-1,3,3a,4-tetrahydrobenz[f]azulene-2,2-dicarboxylic acid diethyl ester Formula: C20H22O5 MolecularWeight: 342.38568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2CC(=O)C3=CC=CC=C3C=C2C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC2CC(=O)C3=CC=CC=C3C=C2C1)C(=O)OCC

InChI

InChI=1S/C20H22O5/c1-3-24-18(22)20(19(23)25-4-2)11-14-9-13-7-5-6-8-16(13)17(21)10-15(14)12-20/h5-9,15H,3-4,10-12H2,1-2H3