1,3-bis(oxidanylidene)-2-(4-sulfanylphenyl)isoindole-5-carboxylic acid

Systemtic Name: 1,3-bis(oxidanylidene)-2-(4-sulfanylphenyl)isoindole-5-carboxylic acid Openeye Name: 1,3-dioxo-2-(4-sulfanylphenyl)isoindoline-5-carboxylic acid CAS Name: 2-(4-mercaptophenyl)-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 1,3-dioxo-2-(4-sulfanylphenyl)isoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-(4-mercaptophenyl)isoindoline-5-carboxylic acid Formula: C15H9NO4S MolecularWeight: 299.30126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)S

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)S

InChI

InChI=1S/C15H9NO4S/c17-13-11-6-1-8(15(19)20)7-12(11)14(18)16(13)9-2-4-10(21)5-3-9/h1-7,21H,(H,19,20)