(Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-but-2-enoic acid

Systemtic Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-but-2-enoic acid Openeye Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-but-2-enoic acid CAS Name: (Z)-2-(5-hexyl-2-pyrimidinyl)-4-phenyl-2-butenoic acid IUPAC Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenylbut-2-enoic acid Traditional Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-but-2-enoic acid Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C(=CCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)/C(=C/CC2=CC=CC=C2)/C(=O)O

InChI

InChI=1S/C20H24N2O2/c1-2-3-4-6-11-17-14-21-19(22-15-17)18(20(23)24)13-12-16-9-7-5-8-10-16/h5,7-10,13-15H,2-4,6,11-12H2,1H3,(H,23,24)/b18-13-