4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(oxolan-2-ylmethylsulfanyl)benzoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(oxolan-2-ylmethylsulfanyl)benzoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoate CAS Name: 2-(2-oxolanylmethylthio)benzoic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-(oxolan-2-ylmethylsulfanyl)benzoate Traditional Name: 2-(tetrahydrofurfurylthio)benzoic acid 4-phthalimidobutyl ester Formula: C24H25NO5S MolecularWeight: 439.524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CC(OC1)CSC2=CC=CC=C2C(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25NO5S/c26-22-18-9-1-2-10-19(18)23(27)25(22)13-5-6-14-30-24(28)20-11-3-4-12-21(20)31-16-17-8-7-15-29-17/h1-4,9-12,17H,5-8,13-16H2