4-(4-ethylpiperazin-1-yl)-3-(phenylsulfonylamino)benzoic acid

Systemtic Name: 4-(4-ethylpiperazin-1-yl)-3-(phenylsulfonylamino)benzoic acid Openeye Name: 3-(benzenesulfonamido)-4-(4-ethylpiperazin-1-yl)benzoic acid CAS Name: 3-(benzenesulfonamido)-4-(4-ethyl-1-piperazinyl)benzoic acid IUPAC Name: 3-(benzenesulfonamido)-4-(4-ethylpiperazin-1-yl)benzoic acid Traditional Name: 3-(benzenesulfonamido)-4-(4-ethylpiperazino)benzoic acid Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O4S/c1-2-21-10-12-22(13-11-21)18-9-8-15(19(23)24)14-17(18)20-27(25,26)16-6-4-3-5-7-16/h3-9,14,20H,2,10-13H2,1H3,(H,23,24)