(3-chloranyl-5-ethylsulfonyloxy-phenyl) 4-(2-methylpropanoylamino)benzoate

Systemtic Name: (3-chloranyl-5-ethylsulfonyloxy-phenyl) 4-(2-methylpropanoylamino)benzoate Openeye Name: (3-chloro-5-ethylsulfonyloxy-phenyl) 4-(2-methylpropanoylamino)benzoate CAS Name: 4-[(2-methyl-1-oxopropyl)amino]benzoic acid (3-chloro-5-ethylsulfonyloxyphenyl) ester IUPAC Name: (3-chloro-5-ethylsulfonyloxyphenyl) 4-(2-methylpropanoylamino)benzoate Traditional Name: 4-(isobutyrylamino)benzoic acid (3-chloro-5-esyloxy-phenyl) ester Formula: C19H20ClNO6S MolecularWeight: 425.8832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)NC(=O)C(C)C)Cl

Isomeric SMILES

CCS(=O)(=O)OC1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)NC(=O)C(C)C)Cl

InChI

InChI=1S/C19H20ClNO6S/c1-4-28(24,25)27-17-10-14(20)9-16(11-17)26-19(23)13-5-7-15(8-6-13)21-18(22)12(2)3/h5-12H,4H2,1-3H3,(H,21,22)