methyl 3-[[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-benzoyl]amino]benzoate CAS Name: 3-[[[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzoyl]amino]benzoate Traditional Name: 3-[[5-(diethylsulfamoyl)-2-pyrrolidino-benzoyl]amino]benzoic acid methyl ester Formula: C23H29N3O5S MolecularWeight: 459.55846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C23H29N3O5S/c1-4-26(5-2)32(29,30)19-11-12-21(25-13-6-7-14-25)20(16-19)22(27)24-18-10-8-9-17(15-18)23(28)31-3/h8-12,15-16H,4-7,13-14H2,1-3H3,(H,24,27)