[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate

Systemtic Name: [(2S)-1-methoxy-1-oxidanylidene-propan-2-yl] 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate Openeye Name: [(1S)-2-methoxy-1-methyl-2-oxo-ethyl] 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-methoxy-benzoate CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-methoxybenzoic acid [(2S)-1-methoxy-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-methoxy-1-oxopropan-2-yl] 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoate Traditional Name: 2-methoxy-5-(phthalimidomethyl)benzoic acid [(1S)-2-keto-2-methoxy-1-methyl-ethyl] ester Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC(=O)C1=C(C=CC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)OC

Isomeric SMILES

C[C@@H](C(=O)OC)OC(=O)C1=C(C=CC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H19NO7/c1-12(20(25)28-3)29-21(26)16-10-13(8-9-17(16)27-2)11-22-18(23)14-6-4-5-7-15(14)19(22)24/h4-10,12H,11H2,1-3H3/t12-/m0/s1