diethyl 5-oxidanylidene-6-phenyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate

Systemtic Name: diethyl 5-oxidanylidene-6-phenyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate Openeye Name: diethyl 5-oxo-6-phenyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate CAS Name: 5-oxo-6-phenyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-oxo-6-phenyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate Traditional Name: 5-keto-6-phenyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylic acid diethyl ester Formula: C20H22O5 MolecularWeight: 342.38568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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