3-(4-ethoxycarbonylpiperazin-1-yl)sulfonyl-4-fluoranyl-benzoate

Systemtic Name: 3-(4-ethoxycarbonylpiperazin-1-yl)sulfonyl-4-fluoranyl-benzoate Openeye Name: 3-(4-ethoxycarbonylpiperazin-1-yl)sulfonyl-4-fluoro-benzoate CAS Name: 3-[(4-ethoxycarbonyl-1-piperazinyl)sulfonyl]-4-fluorobenzoate IUPAC Name: 3-(4-ethoxycarbonylpiperazin-1-yl)sulfonyl-4-fluorobenzoate Traditional Name: 3-(4-carbethoxypiperazino)sulfonyl-4-fluoro-benzoate Formula: C14H16FN2O6S- MolecularWeight: 359.350043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)[O-])F

InChI

InChI=1S/C14H17FN2O6S/c1-2-23-14(20)16-5-7-17(8-6-16)24(21,22)12-9-10(13(18)19)3-4-11(12)15/h3-4,9H,2,5-8H2,1H3,(H,18,19)/p-1