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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 1-(4-ethanoylphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-acetylphenyl)sulfonyl-2-piperidinecarboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-acetylphenyl)sulfonylpipecolinic acid phthalimidomethyl ester Formula: C23H22N2O7S MolecularWeight: 470.49498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22N2O7S/c1-15(26)16-9-11-17(12-10-16)33(30,31)25-13-5-4-8-20(25)23(29)32-14-24-21(27)18-6-2-3-7-19(18)22(24)28/h2-3,6-7,9-12,20H,4-5,8,13-14H2,1H3