2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(4-nitrophenyl)sulfanylethanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(4-nitrophenyl)sulfanylethanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(4-nitrophenyl)sulfanylacetate CAS Name: 2-[(4-nitrophenyl)thio]acetic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(4-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-nitrophenyl)thio]acetic acid 2-phthalimidoethyl ester Formula: C18H14N2O6S MolecularWeight: 386.37856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O6S/c21-16(11-27-13-7-5-12(6-8-13)20(24)25)26-10-9-19-17(22)14-3-1-2-4-15(14)18(19)23/h1-8H,9-11H2