5-[5-(2,6-dimethyl-4-thiophen-2-yl-phenoxy)pentyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[5-(2,6-dimethyl-4-thiophen-2-yl-phenoxy)pentyl]-3-methyl-1,2-oxazole Openeye Name: 5-[5-[2,6-dimethyl-4-(2-thienyl)phenoxy]pentyl]-3-methyl-isoxazole CAS Name: 5-[5-(2,6-dimethyl-4-thiophen-2-ylphenoxy)pentyl]-3-methylisoxazole IUPAC Name: 5-[5-(2,6-dimethyl-4-thiophen-2-ylphenoxy)pentyl]-3-methyl-1,2-oxazole Traditional Name: 5-[5-[2,6-dimethyl-4-(2-thienyl)phenoxy]pentyl]-3-methyl-isoxazole Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCCCC2=CC(=NO2)C)C)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC(=C1OCCCCCC2=CC(=NO2)C)C)C3=CC=CS3

InChI

InChI=1S/C21H25NO2S/c1-15-12-18(20-9-7-11-25-20)13-16(2)21(15)23-10-6-4-5-8-19-14-17(3)22-24-19/h7,9,11-14H,4-6,8,10H2,1-3H3