[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid phthalimidomethyl ester Formula: C21H20N2O7S MolecularWeight: 444.4577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H20N2O7S/c1-14-6-7-15(12-18(14)31(27,28)22-8-10-29-11-9-22)21(26)30-13-23-19(24)16-4-2-3-5-17(16)20(23)25/h2-7,12H,8-11,13H2,1H3