2-oxidanylidenepropyl 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-benzoate

Systemtic Name: 2-oxidanylidenepropyl 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-ethoxy-benzoate Openeye Name: acetonyl 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-ethoxy-benzoate CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-ethoxybenzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxybenzoate Traditional Name: 2-ethoxy-5-(phthalimidomethyl)benzoic acid acetonyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC(=O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC(=O)C

InChI

InChI=1S/C21H19NO6/c1-3-27-18-9-8-14(10-17(18)21(26)28-12-13(2)23)11-22-19(24)15-6-4-5-7-16(15)20(22)25/h4-10H,3,11-12H2,1-2H3