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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-methoxy-benzoate CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-methoxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzoate Traditional Name: 2-methoxy-5-(phthalimidomethyl)benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C25H18N2O5S MolecularWeight: 458.48582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H18N2O5S/c1-31-20-11-10-15(13-27-23(28)16-6-2-3-7-17(16)24(27)29)12-18(20)25(30)32-14-22-26-19-8-4-5-9-21(19)33-22/h2-12H,13-14H2,1H3