[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid phthalimidomethyl ester Formula: C23H14N2O4S MolecularWeight: 414.43326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H14N2O4S/c24-13-15-7-1-5-11-19(15)30-20-12-6-4-10-18(20)23(28)29-14-25-21(26)16-8-2-3-9-17(16)22(25)27/h1-12H,14H2