(Z)-2-(5-pentylpyrimidin-2-yl)-4-phenyl-non-2-enoic acid

Systemtic Name: (Z)-2-(5-pentylpyrimidin-2-yl)-4-phenyl-non-2-enoic acid Openeye Name: (Z)-2-(5-pentylpyrimidin-2-yl)-4-phenyl-non-2-enoic acid CAS Name: (Z)-2-(5-pentyl-2-pyrimidinyl)-4-phenyl-2-nonenoic acid IUPAC Name: (Z)-2-(5-pentylpyrimidin-2-yl)-4-phenylnon-2-enoic acid Traditional Name: (Z)-2-(5-amylpyrimidin-2-yl)-4-phenyl-non-2-enoic acid Formula: C24H32N2O2 MolecularWeight: 380.52308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C(=CC(CCCCC)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O2/c1-3-5-8-12-19-17-25-23(26-18-19)22(24(27)28)16-21(15-9-6-4-2)20-13-10-7-11-14-20/h7,10-11,13-14,16-18,21H,3-6,8-9,12,15H2,1-2H3,(H,27,28)/b22-16-