4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid 4-phthalimidobutyl ester Formula: C24H25ClN2O6S MolecularWeight: 504.9831

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25ClN2O6S/c25-21-11-10-17(34(31,32)26-12-4-1-5-13-26)16-20(21)24(30)33-15-7-6-14-27-22(28)18-8-2-3-9-19(18)23(27)29/h2-3,8-11,16H,1,4-7,12-15H2