5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-2-oxidanyl-benzoate

Systemtic Name: 5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-benzoate CAS Name: 2-hydroxy-5-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]benzoate IUPAC Name: 2-hydroxy-5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 2-hydroxy-5-[4-(2-methoxyphenyl)piperazino]sulfonyl-benzoate Formula: C18H19N2O6S- MolecularWeight: 391.41826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)O)C(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)O)C(=O)[O-]

InChI

InChI=1S/C18H20N2O6S/c1-26-17-5-3-2-4-15(17)19-8-10-20(11-9-19)27(24,25)13-6-7-16(21)14(12-13)18(22)23/h2-7,12,21H,8-11H2,1H3,(H,22,23)/p-1