ethyl 4-[3-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfonylphenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfonylphenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-(1,1-dioxothiolan-3-yl)sulfonylphenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[3-[(1,1-dioxo-3-thiolanyl)sulfonyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1,1-dioxothiolan-3-yl)sulfonylphenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[3-(1,1-diketothiolan-3-yl)sulfonylphenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C17H24N2O8S3 MolecularWeight: 480.57606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C17H24N2O8S3/c1-2-27-17(20)18-7-9-19(10-8-18)30(25,26)15-5-3-4-14(12-15)29(23,24)16-6-11-28(21,22)13-16/h3-5,12,16H,2,6-11,13H2,1H3