3-(dimethylamino)propyl 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate

Systemtic Name: 3-(dimethylamino)propyl 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate Openeye Name: 3-(dimethylamino)propyl 4-chloro-2-(2-furylmethylamino)-5-sulfamoyl-benzoate CAS Name: 4-chloro-2-(2-furanylmethylamino)-5-sulfamoylbenzoic acid 3-(dimethylamino)propyl ester IUPAC Name: 3-(dimethylamino)propyl 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoate Traditional Name: 4-chloro-2-(2-furfurylamino)-5-sulfamoyl-benzoic acid 3-(dimethylamino)propyl ester Formula: C17H22ClN3O5S MolecularWeight: 415.89168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC(=O)C1=CC(=C(C=C1NCC2=CC=CO2)Cl)S(=O)(=O)N

Isomeric SMILES

CN(C)CCCOC(=O)C1=CC(=C(C=C1NCC2=CC=CO2)Cl)S(=O)(=O)N

InChI

InChI=1S/C17H22ClN3O5S/c1-21(2)6-4-8-26-17(22)13-9-16(27(19,23)24)14(18)10-15(13)20-11-12-5-3-7-25-12/h3,5,7,9-10,20H,4,6,8,11H2,1-2H3,(H2,19,23,24)