2-(3-chloranyl-4-pentyl-phenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine

Systemtic Name: 2-(3-chloranyl-4-pentyl-phenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine Openeye Name: 2-(3-chloro-4-pentyl-phenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine CAS Name: 2-(3-chloro-4-pentylphenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine IUPAC Name: 2-(3-chloro-4-pentylphenyl)-5-[(4-pentylcyclohexyl)methoxy]pyrimidine Traditional Name: 2-(4-amyl-3-chloro-phenyl)-5-[(4-amylcyclohexyl)methoxy]pyrimidine Formula: C27H39ClN2O MolecularWeight: 443.06436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)COC2=CN=C(N=C2)C3=CC(=C(C=C3)CCCCC)Cl

Isomeric SMILES

CCCCCC1CCC(CC1)COC2=CN=C(N=C2)C3=CC(=C(C=C3)CCCCC)Cl

InChI

InChI=1S/C27H39ClN2O/c1-3-5-7-9-21-11-13-22(14-12-21)20-31-25-18-29-27(30-19-25)24-16-15-23(26(28)17-24)10-8-6-4-2/h15-19,21-22H,3-14,20H2,1-2H3