3,4-dihydro-2H-1,5-benzoxathiepine-9-carboxylic acid

Systemtic Name: 3,4-dihydro-2H-1,5-benzoxathiepine-9-carboxylic acid Openeye Name: 3,4-dihydro-2H-1,5-benzoxathiepine-9-carboxylic acid CAS Name: 3,4-dihydro-2H-1,5-benzoxathiepin-9-carboxylic acid IUPAC Name: 3,4-dihydro-2H-1,5-benzoxathiepine-9-carboxylic acid Traditional Name: 3,4-dihydro-2H-1,5-benzoxathiepin-9-carboxylic acid Formula: C10H10O3S MolecularWeight: 210.2496

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC=C2SC1)C(=O)O

Isomeric SMILES

C1COC2=C(C=CC=C2SC1)C(=O)O

InChI

InChI=1S/C10H10O3S/c11-10(12)7-3-1-4-8-9(7)13-5-2-6-14-8/h1,3-4H,2,5-6H2,(H,11,12)