CHEBI:59007 - 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid

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ChEBI Name 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid ChEBI ID CHEBI:59007 Definition A 4-ethoxy-3-carboxybenzenesulfonamide in which the sulfonamide nitrogen is a member of a piperazine ring. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H20N2O5S Net Charge 0 Average Mass 328.38400 Monoisotopic Mass 328.10929 InChI InChI=1S/C14H20N2O5S/c1-3-21-13-5-4-11(10-12(13)14(17)18)22(19,20)16-8-6-15(2)7-9-16/h4-5,10H,3,6-9H2,1-2H3,(H,17,18) InChIKey TXKSEEXWAGLOIY-UHFFFAOYSA-N SMILES CCOc1ccc(cc1C(O)=O)S(=O)(=O)N1CCN(C)CC1 ChEBI Ontology Outgoing 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid (CHEBI:59007) has functional parent benzoic acid (CHEBI:30746) 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid (CHEBI:59007) is a piperazines (CHEBI:26144) 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid (CHEBI:59007) is a sulfonamide (CHEBI:35358) IUPAC Name 2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]benzoic acid Registry Number Type Source 9212723 Beilstein Registry Number Beilstein Last Modified 02 March 2010