[4-(5-pentylpyrimidin-2-yl)phenyl] (E)-4-cyclohexylbut-2-enoate

Systemtic Name: [4-(5-pentylpyrimidin-2-yl)phenyl] (E)-4-cyclohexylbut-2-enoate Openeye Name: [4-(5-pentylpyrimidin-2-yl)phenyl] (E)-4-cyclohexylbut-2-enoate CAS Name: (E)-4-cyclohexyl-2-butenoic acid [4-(5-pentyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-pentylpyrimidin-2-yl)phenyl] (E)-4-cyclohexylbut-2-enoate Traditional Name: (E)-4-cyclohexylbut-2-enoic acid [4-(5-amylpyrimidin-2-yl)phenyl] ester Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C=CCC3CCCCC3

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)/C=C/CC3CCCCC3

InChI

InChI=1S/C25H32N2O2/c1-2-3-5-11-21-18-26-25(27-19-21)22-14-16-23(17-15-22)29-24(28)13-8-12-20-9-6-4-7-10-20/h8,13-20H,2-7,9-12H2,1H3/b13-8+