(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-chloranyl-2-methoxy-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-chloranyl-2-methoxy-benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 5-chloro-4-(1,3-dioxoisoindolin-2-yl)-2-methoxy-benzoate CAS Name: 5-chloro-4-(1,3-dioxo-2-isoindolyl)-2-methoxybenzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 5-chloro-4-(1,3-dioxoisoindol-2-yl)-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-4-phthalimido-benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C22H19ClN2O7 MolecularWeight: 458.84846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC(=O)N2CCOCC2)Cl)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC(=O)N2CCOCC2)Cl)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H19ClN2O7/c1-30-18-11-17(25-20(27)13-4-2-3-5-14(13)21(25)28)16(23)10-15(18)22(29)32-12-19(26)24-6-8-31-9-7-24/h2-5,10-11H,6-9,12H2,1H3