2-oxidanylidene-2-(7-oxidanylidenebenzo[7]annulen-5-yl)sulfanyl-ethanoic acid

Systemtic Name: 2-oxidanylidene-2-(7-oxidanylidenebenzo[7]annulen-5-yl)sulfanyl-ethanoic acid Openeye Name: 2-oxo-2-(7-oxobenzo[7]annulen-5-yl)sulfanyl-acetic acid CAS Name: 2-oxo-2-[(7-oxo-5-benzo[7]annulenyl)thio]acetic acid IUPAC Name: 2-oxo-2-(7-oxobenzo[7]annulen-5-yl)sulfanylacetic acid Traditional Name: 2-keto-2-[(7-ketobenzocyclohepten-5-yl)thio]acetic acid Formula: C13H8O4S MolecularWeight: 260.26522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C=C2SC(=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=O)C=C2SC(=O)C(=O)O

InChI

InChI=1S/C13H8O4S/c14-9-6-5-8-3-1-2-4-10(8)11(7-9)18-13(17)12(15)16/h1-7H,(H,15,16)