2-[4-[(2-butyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)methyl]phenoxy]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[(2-butyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)methyl]phenoxy]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[(2-butyl-6-oxo-4-phenyl-pyrimidin-1-yl)methyl]phenoxy]-2-phenyl-acetic acid CAS Name: 2-[4-[(2-butyl-6-oxo-4-phenyl-1-pyrimidinyl)methyl]phenoxy]-2-phenylacetic acid IUPAC Name: 2-[4-[(2-butyl-6-oxo-4-phenylpyrimidin-1-yl)methyl]phenoxy]-2-phenylacetic acid Traditional Name: 2-[4-[(2-butyl-6-keto-4-phenyl-pyrimidin-1-yl)methyl]phenoxy]-2-phenyl-acetic acid Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CC(=O)N1CC2=CC=C(C=C2)OC(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC(=CC(=O)N1CC2=CC=C(C=C2)OC(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C29H28N2O4/c1-2-3-14-26-30-25(22-10-6-4-7-11-22)19-27(32)31(26)20-21-15-17-24(18-16-21)35-28(29(33)34)23-12-8-5-9-13-23/h4-13,15-19,28H,2-3,14,20H2,1H3,(H,33,34)