[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-iodophenyl)sulfamoyl]benzoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-iodophenyl)sulfamoyl]benzoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[(4-iodophenyl)sulfamoyl]benzoic acid [2-keto-2-(piperonylamino)ethyl] ester Formula: C23H18ClIN2O7S MolecularWeight: 628.82069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)I)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)I)Cl

InChI

InChI=1S/C23H18ClIN2O7S/c24-19-7-6-17(35(30,31)27-16-4-2-15(25)3-5-16)10-18(19)23(29)32-12-22(28)26-11-14-1-8-20-21(9-14)34-13-33-20/h1-10,27H,11-13H2,(H,26,28)