5-[3-(2,6-dimethyl-4-phenyl-phenoxy)propyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[3-(2,6-dimethyl-4-phenyl-phenoxy)propyl]-3-methyl-1,2-oxazole Openeye Name: 5-[3-(2,6-dimethyl-4-phenyl-phenoxy)propyl]-3-methyl-isoxazole CAS Name: 5-[3-(2,6-dimethyl-4-phenylphenoxy)propyl]-3-methylisoxazole IUPAC Name: 5-[3-(2,6-dimethyl-4-phenylphenoxy)propyl]-3-methyl-1,2-oxazole Traditional Name: 5-[3-(2,6-dimethyl-4-phenyl-phenoxy)propyl]-3-methyl-isoxazole Formula: C21H23NO2 MolecularWeight: 321.41282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO2/c1-15-12-19(18-8-5-4-6-9-18)13-16(2)21(15)23-11-7-10-20-14-17(3)22-24-20/h4-6,8-9,12-14H,7,10-11H2,1-3H3