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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid phthalimidomethyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O6S/c25-20(30-15-24-21(26)18-6-2-3-7-19(18)22(24)27)14-16-8-10-17(11-9-16)31(28,29)23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-15H2