[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid phthalimidomethyl ester Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N2O6S/c26-21(31-16-25-22(27)19-6-2-3-7-20(19)23(25)28)13-10-17-8-11-18(12-9-17)32(29,30)24-14-4-1-5-15-24/h2-3,6-9,11-12H,1,4-5,10,13-16H2