2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid 2-phthalimidoethyl ester Formula: C20H20N2O6S2 MolecularWeight: 448.5126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H20N2O6S2/c23-18-15-4-1-2-5-16(15)19(24)22(18)11-12-28-20(25)14-7-9-21(10-8-14)30(26,27)17-6-3-13-29-17/h1-6,13-14H,7-12H2