5-[[4-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]phenyl]sulfamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 5-[[4-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]phenyl]sulfamoyl]naphthalene-1-carboxylic acid Openeye Name: 5-[[4-[(3-chloro-2,2-dimethyl-propanoyl)amino]phenyl]sulfamoyl]naphthalene-1-carboxylic acid CAS Name: 5-[[4-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]phenyl]sulfamoyl]-1-naphthalenecarboxylic acid IUPAC Name: 5-[[4-[(3-chloro-2,2-dimethylpropanoyl)amino]phenyl]sulfamoyl]naphthalene-1-carboxylic acid Traditional Name: 5-[[4-[(3-chloro-2,2-dimethyl-propanoyl)amino]phenyl]sulfamoyl]-1-naphthoic acid Formula: C22H21ClN2O5S MolecularWeight: 460.93054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)NC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3C(=O)O

Isomeric SMILES

CC(C)(CCl)C(=O)NC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3C(=O)O

InChI

InChI=1S/C22H21ClN2O5S/c1-22(2,13-23)21(28)24-14-9-11-15(12-10-14)25-31(29,30)19-8-4-5-16-17(19)6-3-7-18(16)20(26)27/h3-12,25H,13H2,1-2H3,(H,24,28)(H,26,27)