3-[[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]sulfamoyl]-4-methyl-benzoate

Systemtic Name: 3-[[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]sulfamoyl]-4-methyl-benzoate Openeye Name: 3-[[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]sulfamoyl]-4-methyl-benzoate CAS Name: 3-[[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]sulfamoyl]-4-methylbenzoate IUPAC Name: 3-[[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]sulfamoyl]-4-methylbenzoate Traditional Name: 3-[[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]sulfamoyl]-4-methyl-benzoate Formula: C21H16N3O5S- MolecularWeight: 422.43384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NC2=C(C=C(C=C2)OC3=C(C=CC=N3)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NC2=C(C=C(C=C2)OC3=C(C=CC=N3)C#N)C

InChI

InChI=1S/C21H17N3O5S/c1-13-5-6-15(21(25)26)11-19(13)30(27,28)24-18-8-7-17(10-14(18)2)29-20-16(12-22)4-3-9-23-20/h3-11,24H,1-2H3,(H,25,26)/p-1