3-(4-ethylphenyl)-5-(oxan-4-yl)-1H-pyrazole

Systemtic Name: 3-(4-ethylphenyl)-5-(oxan-4-yl)-1H-pyrazole Openeye Name: 3-(4-ethylphenyl)-5-tetrahydropyran-4-yl-1H-pyrazole CAS Name: 3-(4-ethylphenyl)-5-(4-oxanyl)-1H-pyrazole IUPAC Name: 3-(4-ethylphenyl)-5-(oxan-4-yl)-1H-pyrazole Traditional Name: 3-(4-ethylphenyl)-5-tetrahydropyran-4-yl-1H-pyrazole Formula: C16H20N2O MolecularWeight: 256.3428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NNC(=C2)C3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NNC(=C2)C3CCOCC3

InChI

InChI=1S/C16H20N2O/c1-2-12-3-5-13(6-4-12)15-11-16(18-17-15)14-7-9-19-10-8-14/h3-6,11,14H,2,7-10H2,1H3,(H,17,18)