4-[5-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)amino]naphthalen-1-yl]oxybutanoic acid

Systemtic Name: 4-[5-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)amino]naphthalen-1-yl]oxybutanoic acid Openeye Name: 4-[[5-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)amino]-1-naphthyl]oxy]butanoic acid CAS Name: 4-[[5-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)amino]-1-naphthalenyl]oxy]butanoic acid IUPAC Name: 4-[5-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)amino]naphthalen-1-yl]oxybutanoic acid Traditional Name: 4-[5-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)amino]-1-naphthoxy]butyric acid Formula: C24H21N3O4 MolecularWeight: 415.44124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)NC3=CC=CC4=C3C=CC=C4OCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)NC3=CC=CC4=C3C=CC=C4OCCCC(=O)O

InChI

InChI=1S/C24H21N3O4/c28-22-15-20(16-7-2-1-3-8-16)26-24(27-22)25-19-11-4-10-18-17(19)9-5-12-21(18)31-14-6-13-23(29)30/h1-5,7-12,15H,6,13-14H2,(H,29,30)(H2,25,26,27,28)