dimethyl 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-oxidanylidene-2,6-dithiophen-2-yl-piperidine-3,5-dicarboxylate

Systemtic Name: dimethyl 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-oxidanylidene-2,6-dithiophen-2-yl-piperidine-3,5-dicarboxylate Openeye Name: dimethyl 1-(1,1-dioxothiolan-3-yl)-4-oxo-2,6-bis(2-thienyl)piperidine-3,5-dicarboxylate CAS Name: 1-(1,1-dioxo-3-thiolanyl)-4-oxo-2,6-dithiophen-2-ylpiperidine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(1,1-dioxothiolan-3-yl)-4-oxo-2,6-dithiophen-2-ylpiperidine-3,5-dicarboxylate Traditional Name: 1-(1,1-diketothiolan-3-yl)-4-keto-2,6-bis(2-thienyl)piperidine-3,5-dicarboxylic acid dimethyl ester Formula: C21H23NO7S3 MolecularWeight: 497.60482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N(C(C(C1=O)C(=O)OC)C2=CC=CS2)C3CCS(=O)(=O)C3)C4=CC=CS4

Isomeric SMILES

COC(=O)C1C(N(C(C(C1=O)C(=O)OC)C2=CC=CS2)C3CCS(=O)(=O)C3)C4=CC=CS4

InChI

InChI=1S/C21H23NO7S3/c1-28-20(24)15-17(13-5-3-8-30-13)22(12-7-10-32(26,27)11-12)18(14-6-4-9-31-14)16(19(15)23)21(25)29-2/h3-6,8-9,12,15-18H,7,10-11H2,1-2H3