(E)-2-(2-methylpyrimidin-5-yl)-10-phenylmethoxy-dec-4-enoic acid

Systemtic Name: (E)-2-(2-methylpyrimidin-5-yl)-10-phenylmethoxy-dec-4-enoic acid Openeye Name: (E)-10-benzyloxy-2-(2-methylpyrimidin-5-yl)dec-4-enoic acid CAS Name: (E)-2-(2-methyl-5-pyrimidinyl)-10-phenylmethoxy-4-decenoic acid IUPAC Name: (E)-2-(2-methylpyrimidin-5-yl)-10-phenylmethoxydec-4-enoic acid Traditional Name: (E)-10-benzoxy-2-(2-methylpyrimidin-5-yl)dec-4-enoic acid Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C(CC=CCCCCCOCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=NC=C(C=N1)C(C/C=C/CCCCCOCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H28N2O3/c1-18-23-15-20(16-24-18)21(22(25)26)13-9-4-2-3-5-10-14-27-17-19-11-7-6-8-12-19/h4,6-9,11-12,15-16,21H,2-3,5,10,13-14,17H2,1H3,(H,25,26)/b9-4+