5-decyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]pyrimidine

Systemtic Name: 5-decyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]pyrimidine Openeye Name: 5-decyl-2-[4-[(E)-3-(4-pentylcyclohexyl)allyloxy]phenyl]pyrimidine CAS Name: 5-decyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]pyrimidine IUPAC Name: 5-decyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]pyrimidine Traditional Name: 2-[4-[(E)-3-(4-amylcyclohexyl)allyloxy]phenyl]-5-decyl-pyrimidine Formula: C34H52N2O MolecularWeight: 504.78948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC=CC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC/C=C/C3CCC(CC3)CCCCC

InChI

InChI=1S/C34H52N2O/c1-3-5-7-8-9-10-11-13-16-31-27-35-34(36-28-31)32-22-24-33(25-23-32)37-26-14-17-30-20-18-29(19-21-30)15-12-6-4-2/h14,17,22-25,27-30H,3-13,15-16,18-21,26H2,1-2H3/b17-14+