3-[4-[(3-chloranyl-4-methyl-phenyl)sulfamoyl]phenyl]propanoate

Systemtic Name: 3-[4-[(3-chloranyl-4-methyl-phenyl)sulfamoyl]phenyl]propanoate Openeye Name: 3-[4-[(3-chloro-4-methyl-phenyl)sulfamoyl]phenyl]propanoate CAS Name: 3-[4-[(3-chloro-4-methylphenyl)sulfamoyl]phenyl]propanoate IUPAC Name: 3-[4-[(3-chloro-4-methylphenyl)sulfamoyl]phenyl]propanoate Traditional Name: 3-[4-[(3-chloro-4-methyl-phenyl)sulfamoyl]phenyl]propionate Formula: C16H15ClNO4S- MolecularWeight: 352.8126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)[O-])Cl

InChI

InChI=1S/C16H16ClNO4S/c1-11-2-6-13(10-15(11)17)18-23(21,22)14-7-3-12(4-8-14)5-9-16(19)20/h2-4,6-8,10,18H,5,9H2,1H3,(H,19,20)/p-1