5-[(3,4-dichlorophenyl)sulfonylamino]-2-(4-methylpiperazin-1-yl)benzoic acid

Systemtic Name: 5-[(3,4-dichlorophenyl)sulfonylamino]-2-(4-methylpiperazin-1-yl)benzoic acid Openeye Name: 5-[(3,4-dichlorophenyl)sulfonylamino]-2-(4-methylpiperazin-1-yl)benzoic acid CAS Name: 5-[(3,4-dichlorophenyl)sulfonylamino]-2-(4-methyl-1-piperazinyl)benzoic acid IUPAC Name: 5-[(3,4-dichlorophenyl)sulfonylamino]-2-(4-methylpiperazin-1-yl)benzoic acid Traditional Name: 5-[(3,4-dichlorophenyl)sulfonylamino]-2-(4-methylpiperazino)benzoic acid Formula: C18H19Cl2N3O4S MolecularWeight: 444.33216

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H19Cl2N3O4S/c1-22-6-8-23(9-7-22)17-5-2-12(10-14(17)18(24)25)21-28(26,27)13-3-4-15(19)16(20)11-13/h2-5,10-11,21H,6-9H2,1H3,(H,24,25)