diethyl (5E)-5-(phenylmethylidene)-4-prop-1-en-2-yl-cyclohex-3-ene-1,1-dicarboxylate

Systemtic Name: diethyl (5E)-5-(phenylmethylidene)-4-prop-1-en-2-yl-cyclohex-3-ene-1,1-dicarboxylate Openeye Name: diethyl (5E)-5-benzylidene-4-isopropenyl-cyclohex-3-ene-1,1-dicarboxylate CAS Name: (5E)-4-(1-methylethenyl)-5-(phenylmethylene)cyclohex-3-ene-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (5E)-5-benzylidene-4-prop-1-en-2-ylcyclohex-3-ene-1,1-dicarboxylate Traditional Name: (5E)-5-benzal-4-isopropenyl-cyclohex-3-ene-1,1-dicarboxylic acid diethyl ester Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC=C(C(=CC2=CC=CC=C2)C1)C(=C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC=C(/C(=C/C2=CC=CC=C2)/C1)C(=C)C)C(=O)OCC

InChI

InChI=1S/C22H26O4/c1-5-25-20(23)22(21(24)26-6-2)13-12-19(16(3)4)18(15-22)14-17-10-8-7-9-11-17/h7-12,14H,3,5-6,13,15H2,1-2,4H3/b18-14+