(4-chlorophenyl) 5-[(E)-2-(4-pentylcyclohexyl)ethenyl]pyrimidine-2-carboxylate

Systemtic Name: (4-chlorophenyl) 5-[(E)-2-(4-pentylcyclohexyl)ethenyl]pyrimidine-2-carboxylate Openeye Name: (4-chlorophenyl) 5-[(E)-2-(4-pentylcyclohexyl)vinyl]pyrimidine-2-carboxylate CAS Name: 5-[(E)-2-(4-pentylcyclohexyl)ethenyl]-2-pyrimidinecarboxylic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 5-[(E)-2-(4-pentylcyclohexyl)ethenyl]pyrimidine-2-carboxylate Traditional Name: 5-[(E)-2-(4-amylcyclohexyl)vinyl]pyrimidine-2-carboxylic acid (4-chlorophenyl) ester Formula: C24H29ClN2O2 MolecularWeight: 412.95226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C=CC2=CN=C(N=C2)C(=O)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCC1CCC(CC1)/C=C/C2=CN=C(N=C2)C(=O)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H29ClN2O2/c1-2-3-4-5-18-6-8-19(9-7-18)10-11-20-16-26-23(27-17-20)24(28)29-22-14-12-21(25)13-15-22/h10-19H,2-9H2,1H3/b11-10+