(6-chloranylpyridin-3-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: (6-chloro-3-pyridyl)methyl 4-(1,3-dioxoisoindolin-2-yl)benzoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)benzoic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 4-(1,3-dioxoisoindol-2-yl)benzoate Traditional Name: 4-phthalimidobenzoic acid (6-chloro-3-pyridyl)methyl ester Formula: C21H13ClN2O4 MolecularWeight: 392.79192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OCC4=CN=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OCC4=CN=C(C=C4)Cl

InChI

InChI=1S/C21H13ClN2O4/c22-18-10-5-13(11-23-18)12-28-21(27)14-6-8-15(9-7-14)24-19(25)16-3-1-2-4-17(16)20(24)26/h1-11H,12H2