2-chloranyl-4-methyl-2-[4-(2-nonoxypyrimidin-5-yl)phenyl]pentanoic acid

Systemtic Name: 2-chloranyl-4-methyl-2-[4-(2-nonoxypyrimidin-5-yl)phenyl]pentanoic acid Openeye Name: 2-chloro-4-methyl-2-[4-(2-nonoxypyrimidin-5-yl)phenyl]pentanoic acid CAS Name: 2-chloro-4-methyl-2-[4-(2-nonoxy-5-pyrimidinyl)phenyl]pentanoic acid IUPAC Name: 2-chloro-4-methyl-2-[4-(2-nonoxypyrimidin-5-yl)phenyl]pentanoic acid Traditional Name: 2-chloro-4-methyl-2-[4-(2-nonoxypyrimidin-5-yl)phenyl]valeric acid Formula: C25H35ClN2O3 MolecularWeight: 447.01

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=NC=C(C=N1)C2=CC=C(C=C2)C(CC(C)C)(C(=O)O)Cl

Isomeric SMILES

CCCCCCCCCOC1=NC=C(C=N1)C2=CC=C(C=C2)C(CC(C)C)(C(=O)O)Cl

InChI

InChI=1S/C25H35ClN2O3/c1-4-5-6-7-8-9-10-15-31-24-27-17-21(18-28-24)20-11-13-22(14-12-20)25(26,23(29)30)16-19(2)3/h11-14,17-19H,4-10,15-16H2,1-3H3,(H,29,30)