5-[3-(2-chloranyl-4-ethylsulfonyl-phenoxy)-5-methyl-phenoxy]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[3-(2-chloranyl-4-ethylsulfonyl-phenoxy)-5-methyl-phenoxy]-2H-1,2,3,4-tetrazole Openeye Name: 5-[3-(2-chloro-4-ethylsulfonyl-phenoxy)-5-methyl-phenoxy]-2H-tetrazole CAS Name: 5-[3-(2-chloro-4-ethylsulfonylphenoxy)-5-methylphenoxy]-2H-tetrazole IUPAC Name: 5-[3-(2-chloro-4-ethylsulfonylphenoxy)-5-methylphenoxy]-2H-tetrazole Traditional Name: 5-[3-(2-chloro-4-esyl-phenoxy)-5-methyl-phenoxy]-2H-tetrazole Formula: C16H15ClN4O4S MolecularWeight: 394.8327

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C)OC3=NNN=N3)Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)C)OC3=NNN=N3)Cl

InChI

InChI=1S/C16H15ClN4O4S/c1-3-26(22,23)13-4-5-15(14(17)9-13)24-11-6-10(2)7-12(8-11)25-16-18-20-21-19-16/h4-9H,3H2,1-2H3,(H,18,19,20,21)