4-[3-[3-(4-methoxyoxan-4-yl)phenoxy]prop-1-ynyl]-5-(4-methylsulfonylphenyl)-4-phenyl-5H-1,3-oxazole

Systemtic Name: 4-[3-[3-(4-methoxyoxan-4-yl)phenoxy]prop-1-ynyl]-5-(4-methylsulfonylphenyl)-4-phenyl-5H-1,3-oxazole Openeye Name: 4-[3-[3-(4-methoxytetrahydropyran-4-yl)phenoxy]prop-1-ynyl]-5-(4-methylsulfonylphenyl)-4-phenyl-5H-oxazole CAS Name: 4-[3-[3-(4-methoxy-4-oxanyl)phenoxy]prop-1-ynyl]-5-(4-methylsulfonylphenyl)-4-phenyl-5H-oxazole IUPAC Name: 4-[3-[3-(4-methoxyoxan-4-yl)phenoxy]prop-1-ynyl]-5-(4-methylsulfonylphenyl)-4-phenyl-5H-1,3-oxazole Traditional Name: 5-(4-mesylphenyl)-4-[3-[3-(4-methoxytetrahydropyran-4-yl)phenoxy]prop-1-ynyl]-4-phenyl-2-oxazoline Formula: C31H31NO6S MolecularWeight: 545.64594

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCOCC1)C2=CC(=CC=C2)OCC#CC3(C(OC=N3)C4=CC=C(C=C4)S(=O)(=O)C)C5=CC=CC=C5

Isomeric SMILES

COC1(CCOCC1)C2=CC(=CC=C2)OCC#CC3(C(OC=N3)C4=CC=C(C=C4)S(=O)(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C31H31NO6S/c1-35-30(17-20-36-21-18-30)26-10-6-11-27(22-26)37-19-7-16-31(25-8-4-3-5-9-25)29(38-23-32-31)24-12-14-28(15-13-24)39(2,33)34/h3-6,8-15,22-23,29H,17-21H2,1-2H3