4-(2-methyl-3-oxidanyl-4-pyrimidin-4-yl-butan-2-yl)oxybenzenecarbonitrile

Systemtic Name: 4-(2-methyl-3-oxidanyl-4-pyrimidin-4-yl-butan-2-yl)oxybenzenecarbonitrile Openeye Name: 4-(2-hydroxy-1,1-dimethyl-3-pyrimidin-4-yl-propoxy)benzonitrile CAS Name: 4-[3-hydroxy-2-methyl-4-(4-pyrimidinyl)butan-2-yl]oxybenzonitrile IUPAC Name: 4-(3-hydroxy-2-methyl-4-pyrimidin-4-ylbutan-2-yl)oxybenzonitrile Traditional Name: 4-[2-hydroxy-1,1-dimethyl-3-(4-pyrimidyl)propoxy]benzonitrile Formula: C16H17N3O2 MolecularWeight: 283.32508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CC1=NC=NC=C1)O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C(CC1=NC=NC=C1)O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H17N3O2/c1-16(2,15(20)9-13-7-8-18-11-19-13)21-14-5-3-12(10-17)4-6-14/h3-8,11,15,20H,9H2,1-2H3