diethyl 5-(phenylmethylidene)-1,3-dihydropentalene-2,2-dicarboxylate

Systemtic Name: diethyl 5-(phenylmethylidene)-1,3-dihydropentalene-2,2-dicarboxylate Openeye Name: diethyl 5-benzylidene-1,3-dihydropentalene-2,2-dicarboxylate CAS Name: 5-(phenylmethylene)-1,3-dihydropentalene-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-benzylidene-1,3-dihydropentalene-2,2-dicarboxylate Traditional Name: 5-benzal-1,3-dihydropentalene-2,2-dicarboxylic acid diethyl ester Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=CC(=CC3=CC=CC=C3)C=C2C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC2=CC(=CC3=CC=CC=C3)C=C2C1)C(=O)OCC

InChI

InChI=1S/C21H22O4/c1-3-24-19(22)21(20(23)25-4-2)13-17-11-16(12-18(17)14-21)10-15-8-6-5-7-9-15/h5-12H,3-4,13-14H2,1-2H3