2-[2-(4-hydroxyphenyl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-hydroxyphenyl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-hydroxyphenyl)sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4-hydroxyphenyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-hydroxyphenyl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-hydroxyphenyl)thio]ethyl]isoindoline-1,3-quinone Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=CC=C(C=C3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=CC=C(C=C3)O

InChI

InChI=1S/C16H13NO3S/c18-11-5-7-12(8-6-11)21-10-9-17-15(19)13-3-1-2-4-14(13)16(17)20/h1-8,18H,9-10H2