3-(ethylsulfonylamino)-4-(4-propylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-(ethylsulfonylamino)-4-(4-propylpiperazin-1-yl)benzoic acid Openeye Name: 3-(ethylsulfonylamino)-4-(4-propylpiperazin-1-yl)benzoic acid CAS Name: 3-(ethylsulfonylamino)-4-(4-propyl-1-piperazinyl)benzoic acid IUPAC Name: 3-(ethylsulfonylamino)-4-(4-propylpiperazin-1-yl)benzoic acid Traditional Name: 3-(esylamino)-4-(4-propylpiperazino)benzoic acid Formula: C16H25N3O4S MolecularWeight: 355.4524

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)CC

Isomeric SMILES

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)CC

InChI

InChI=1S/C16H25N3O4S/c1-3-7-18-8-10-19(11-9-18)15-6-5-13(16(20)21)12-14(15)17-24(22,23)4-2/h5-6,12,17H,3-4,7-11H2,1-2H3,(H,20,21)