2-[4-(5-decylpyrimidin-2-yl)phenyl]-4-(2-methylbutyl)benzoic acid

Systemtic Name: 2-[4-(5-decylpyrimidin-2-yl)phenyl]-4-(2-methylbutyl)benzoic acid Openeye Name: 2-[4-(5-decylpyrimidin-2-yl)phenyl]-4-(2-methylbutyl)benzoic acid CAS Name: 2-[4-(5-decyl-2-pyrimidinyl)phenyl]-4-(2-methylbutyl)benzoic acid IUPAC Name: 2-[4-(5-decylpyrimidin-2-yl)phenyl]-4-(2-methylbutyl)benzoic acid Traditional Name: 2-[4-(5-decylpyrimidin-2-yl)phenyl]-4-(2-methylbutyl)benzoic acid Formula: C32H42N2O2 MolecularWeight: 486.68808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=C(C=CC(=C3)CC(C)CC)C(=O)O

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3=C(C=CC(=C3)CC(C)CC)C(=O)O

InChI

InChI=1S/C32H42N2O2/c1-4-6-7-8-9-10-11-12-13-26-22-33-31(34-23-26)28-17-15-27(16-18-28)30-21-25(20-24(3)5-2)14-19-29(30)32(35)36/h14-19,21-24H,4-13,20H2,1-3H3,(H,35,36)