5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxy-benzoic acid

Systemtic Name: 5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxy-benzoic acid Openeye Name: 5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxy-benzoic acid CAS Name: 5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]-2-propoxybenzoic acid IUPAC Name: 5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxybenzoic acid Traditional Name: 5-[4-(2-hydroxyethyl)piperazino]sulfonyl-2-propoxy-benzoic acid Formula: C16H24N2O6S MolecularWeight: 372.43656

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CCO)C(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CCO)C(=O)O

InChI

InChI=1S/C16H24N2O6S/c1-2-11-24-15-4-3-13(12-14(15)16(20)21)25(22,23)18-7-5-17(6-8-18)9-10-19/h3-4,12,19H,2,5-11H2,1H3,(H,20,21)