2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-5-methoxy-pyrimidine

Systemtic Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-5-methoxy-pyrimidine Openeye Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-5-methoxy-pyrimidine CAS Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-5-methoxypyrimidine IUPAC Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-5-methoxypyrimidine Traditional Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-5-methoxy-pyrimidine Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)OC

Isomeric SMILES

CCC1CCC(CC1)C2=CC=C(C=C2)C#CC3=NC=C(C=N3)OC

InChI

InChI=1S/C21H24N2O/c1-3-16-4-9-18(10-5-16)19-11-6-17(7-12-19)8-13-21-22-14-20(24-2)15-23-21/h6-7,11-12,14-16,18H,3-5,9-10H2,1-2H3