diethyl 4-[2-(2-cyanophenyl)ethyl]-3-methyl-cyclopent-2-ene-1,1-dicarboxylate

Systemtic Name: diethyl 4-[2-(2-cyanophenyl)ethyl]-3-methyl-cyclopent-2-ene-1,1-dicarboxylate Openeye Name: diethyl 4-[2-(2-cyanophenyl)ethyl]-3-methyl-cyclopent-2-ene-1,1-dicarboxylate CAS Name: 4-[2-(2-cyanophenyl)ethyl]-3-methylcyclopent-2-ene-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[2-(2-cyanophenyl)ethyl]-3-methylcyclopent-2-ene-1,1-dicarboxylate Traditional Name: 4-[2-(2-cyanophenyl)ethyl]-3-methyl-cyclopent-2-ene-1,1-dicarboxylic acid diethyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(=C1)C)CCC2=CC=CC=C2C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(C(=C1)C)CCC2=CC=CC=C2C#N)C(=O)OCC

InChI

InChI=1S/C21H25NO4/c1-4-25-19(23)21(20(24)26-5-2)12-15(3)17(13-21)11-10-16-8-6-7-9-18(16)14-22/h6-9,12,17H,4-5,10-11,13H2,1-3H3