[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-chloranyl-5-ethoxy-4-propoxy-benzoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 3-chloranyl-5-ethoxy-4-propoxy-benzoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 3-chloro-5-ethoxy-4-propoxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-propoxybenzoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 3-chloro-5-ethoxy-4-propoxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-propoxy-benzoic acid phthalimidomethyl ester Formula: C21H20ClNO6 MolecularWeight: 417.8396

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)OCN2C(=O)C3=CC=CC=C3C2=O)OCC

InChI

InChI=1S/C21H20ClNO6/c1-3-9-28-18-16(22)10-13(11-17(18)27-4-2)21(26)29-12-23-19(24)14-7-5-6-8-15(14)20(23)25/h5-8,10-11H,3-4,9,12H2,1-2H3