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

Systemtic Name: [4-(5-pentylpyridin-2-yl)phenyl] (E)-4-cyclohexylbut-2-enoate Openeye Name: [4-(5-pentyl-2-pyridyl)phenyl] (E)-4-cyclohexylbut-2-enoate CAS Name: (E)-4-cyclohexyl-2-butenoic acid [4-(5-pentyl-2-pyridinyl)phenyl] ester IUPAC Name: [4-(5-pentylpyridin-2-yl)phenyl] (E)-4-cyclohexylbut-2-enoate Traditional Name: (E)-4-cyclohexylbut-2-enoic acid [4-(5-amyl-2-pyridyl)phenyl] ester Formula: C26H33NO2 MolecularWeight: 391.54572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33NO2/c1-2-3-5-11-22-14-19-25(27-20-22)23-15-17-24(18-16-23)29-26(28)13-8-12-21-9-6-4-7-10-21/h8,13-21H,2-7,9-12H2,1H3/b13-8+