2-[4-[(E)-2-chloranylethenyl]cyclohexyl]-5-(4-propoxyphenyl)pyrimidine

Systemtic Name: 2-[4-[(E)-2-chloranylethenyl]cyclohexyl]-5-(4-propoxyphenyl)pyrimidine Openeye Name: 2-[4-[(E)-2-chlorovinyl]cyclohexyl]-5-(4-propoxyphenyl)pyrimidine CAS Name: 2-[4-[(E)-2-chloroethenyl]cyclohexyl]-5-(4-propoxyphenyl)pyrimidine IUPAC Name: 2-[4-[(E)-2-chloroethenyl]cyclohexyl]-5-(4-propoxyphenyl)pyrimidine Traditional Name: 2-[4-[(E)-2-chlorovinyl]cyclohexyl]-5-(4-propoxyphenyl)pyrimidine Formula: C21H25ClN2O MolecularWeight: 356.889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CN=C(N=C2)C3CCC(CC3)C=CCl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CN=C(N=C2)C3CCC(CC3)/C=C/Cl

InChI

InChI=1S/C21H25ClN2O/c1-2-13-25-20-9-7-17(8-10-20)19-14-23-21(24-15-19)18-5-3-16(4-6-18)11-12-22/h7-12,14-16,18H,2-6,13H2,1H3/b12-11+