pyrimidin-5-yl 2-(2-cyclohexylphenyl)cyclopentene-1-carboxylate

Systemtic Name: pyrimidin-5-yl 2-(2-cyclohexylphenyl)cyclopentene-1-carboxylate Openeye Name: pyrimidin-5-yl 2-(2-cyclohexylphenyl)cyclopentene-1-carboxylate CAS Name: 2-(2-cyclohexylphenyl)-1-cyclopentenecarboxylic acid 5-pyrimidinyl ester IUPAC Name: pyrimidin-5-yl 2-(2-cyclohexylphenyl)cyclopentene-1-carboxylate Traditional Name: 2-(2-cyclohexylphenyl)cyclopentene-1-carboxylic acid 5-pyrimidyl ester Formula: C22H24N2O2 MolecularWeight: 348.43816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=CC=C2C3=C(CCC3)C(=O)OC4=CN=CN=C4

Isomeric SMILES

C1CCC(CC1)C2=CC=CC=C2C3=C(CCC3)C(=O)OC4=CN=CN=C4

InChI

InChI=1S/C22H24N2O2/c25-22(26-17-13-23-15-24-14-17)21-12-6-11-20(21)19-10-5-4-9-18(19)16-7-2-1-3-8-16/h4-5,9-10,13-16H,1-3,6-8,11-12H2