3-(dimethylamino)propyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate

Systemtic Name: 3-(dimethylamino)propyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate Openeye Name: 3-(dimethylamino)propyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate CAS Name: 4-phenoxy-3-(1-pyrrolidinyl)-5-sulfamoylbenzoic acid 3-(dimethylamino)propyl ester IUPAC Name: 3-(dimethylamino)propyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoylbenzoate Traditional Name: 4-phenoxy-3-pyrrolidino-5-sulfamoyl-benzoic acid 3-(dimethylamino)propyl ester Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CN(C)CCCOC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C22H29N3O5S/c1-24(2)11-8-14-29-22(26)17-15-19(25-12-6-7-13-25)21(20(16-17)31(23,27)28)30-18-9-4-3-5-10-18/h3-5,9-10,15-16H,6-8,11-14H2,1-2H3,(H2,23,27,28)