4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylisonipecotic acid 4-phthalimidobutyl ester Formula: C24H25FN2O6S MolecularWeight: 488.528503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)OCCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H25FN2O6S/c25-18-7-9-19(10-8-18)34(31,32)26-14-11-17(12-15-26)24(30)33-16-4-3-13-27-22(28)20-5-1-2-6-21(20)23(27)29/h1-2,5-10,17H,3-4,11-16H2