[2-(4-cyanophenyl)pyrimidin-5-yl] 4-hexylcyclohexane-1-carboxylate

Systemtic Name: [2-(4-cyanophenyl)pyrimidin-5-yl] 4-hexylcyclohexane-1-carboxylate Openeye Name: [2-(4-cyanophenyl)pyrimidin-5-yl] 4-hexylcyclohexanecarboxylate CAS Name: 4-hexyl-1-cyclohexanecarboxylic acid [2-(4-cyanophenyl)-5-pyrimidinyl] ester IUPAC Name: [2-(4-cyanophenyl)pyrimidin-5-yl] 4-hexylcyclohexane-1-carboxylate Traditional Name: 4-hexylcyclohexanecarboxylic acid [2-(4-cyanophenyl)pyrimidin-5-yl] ester Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCC1CCC(CC1)C(=O)OC2=CN=C(N=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H29N3O2/c1-2-3-4-5-6-18-7-13-21(14-8-18)24(28)29-22-16-26-23(27-17-22)20-11-9-19(15-25)10-12-20/h9-12,16-18,21H,2-8,13-14H2,1H3