dimethyl 2-hexyl-3-phenyl-cyclopent-3-ene-1,1-dicarboxylate

Systemtic Name: dimethyl 2-hexyl-3-phenyl-cyclopent-3-ene-1,1-dicarboxylate Openeye Name: dimethyl 2-hexyl-3-phenyl-cyclopent-3-ene-1,1-dicarboxylate CAS Name: 2-hexyl-3-phenylcyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-hexyl-3-phenylcyclopent-3-ene-1,1-dicarboxylate Traditional Name: 2-hexyl-3-phenyl-cyclopent-3-ene-1,1-dicarboxylic acid dimethyl ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=CCC1(C(=O)OC)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC1C(=CCC1(C(=O)OC)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C21H28O4/c1-4-5-6-10-13-18-17(16-11-8-7-9-12-16)14-15-21(18,19(22)24-2)20(23)25-3/h7-9,11-12,14,18H,4-6,10,13,15H2,1-3H3