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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid phthalimidomethyl ester Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H19N3O6S/c24-18-16-5-1-2-6-17(16)19(25)23(18)13-29-20(26)14-7-10-22(11-8-14)30(27,28)15-4-3-9-21-12-15/h1-6,9,12,14H,7-8,10-11,13H2