methyl 2-[4-[5-[4-methylsulfonyl-2-(oxidanylcarbamoyl)piperazin-1-yl]sulfonylthiophen-2-yl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[5-[4-methylsulfonyl-2-(oxidanylcarbamoyl)piperazin-1-yl]sulfonylthiophen-2-yl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[5-[2-(hydroxycarbamoyl)-4-methylsulfonyl-piperazin-1-yl]sulfonyl-2-thienyl]phenoxy]acetate CAS Name: 2-[4-[5-[[2-[(hydroxyamino)-oxomethyl]-4-methylsulfonyl-1-piperazinyl]sulfonyl]-2-thiophenyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[5-[2-(hydroxycarbamoyl)-4-methylsulfonylpiperazin-1-yl]sulfonylthiophen-2-yl]phenoxy]acetate Traditional Name: 2-[4-[5-[2-(hydroxycarbamoyl)-4-mesyl-piperazino]sulfonyl-2-thienyl]phenoxy]acetic acid methyl ester Formula: C19H23N3O9S3 MolecularWeight: 533.59562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3C(=O)NO)S(=O)(=O)C

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3C(=O)NO)S(=O)(=O)C

InChI

InChI=1S/C19H23N3O9S3/c1-30-17(23)12-31-14-5-3-13(4-6-14)16-7-8-18(32-16)34(28,29)22-10-9-21(33(2,26)27)11-15(22)19(24)20-25/h3-8,15,25H,9-12H2,1-2H3,(H,20,24)