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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid 2-phthalimidoethyl ester Formula: C22H21ClN2O6S MolecularWeight: 476.92994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21ClN2O6S/c23-19-9-8-15(32(29,30)24-10-4-1-5-11-24)14-18(19)22(28)31-13-12-25-20(26)16-6-2-3-7-17(16)21(25)27/h2-3,6-9,14H,1,4-5,10-13H2