5H-1,2-benzoxathiepine-4-carboxylic acid

Systemtic Name: 5H-1,2-benzoxathiepine-4-carboxylic acid Openeye Name: 5H-1,2-benzoxathiepine-4-carboxylic acid CAS Name: 5H-1,2-benzoxathiepin-4-carboxylic acid IUPAC Name: 5H-1,2-benzoxathiepine-4-carboxylic acid Traditional Name: 5H-1,2-benzoxathiepin-4-carboxylic acid Formula: C10H8O3S MolecularWeight: 208.23372

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OSC=C1C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2OSC=C1C(=O)O

InChI

InChI=1S/C10H8O3S/c11-10(12)8-5-7-3-1-2-4-9(7)13-14-6-8/h1-4,6H,5H2,(H,11,12)