5-[(4-ethanoylphenyl)sulfonylamino]-2-(4-ethylpiperazin-1-yl)benzoic acid

Systemtic Name: 5-[(4-ethanoylphenyl)sulfonylamino]-2-(4-ethylpiperazin-1-yl)benzoic acid Openeye Name: 5-[(4-acetylphenyl)sulfonylamino]-2-(4-ethylpiperazin-1-yl)benzoic acid CAS Name: 5-[(4-acetylphenyl)sulfonylamino]-2-(4-ethyl-1-piperazinyl)benzoic acid IUPAC Name: 5-[(4-acetylphenyl)sulfonylamino]-2-(4-ethylpiperazin-1-yl)benzoic acid Traditional Name: 5-[(4-acetylphenyl)sulfonylamino]-2-(4-ethylpiperazino)benzoic acid Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)C)C(=O)O

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)C)C(=O)O

InChI

InChI=1S/C21H25N3O5S/c1-3-23-10-12-24(13-11-23)20-9-6-17(14-19(20)21(26)27)22-30(28,29)18-7-4-16(5-8-18)15(2)25/h4-9,14,22H,3,10-13H2,1-2H3,(H,26,27)