ethyl 3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate

Systemtic Name: ethyl 3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate Openeye Name: ethyl 3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate CAS Name: 3,5-dihydro-2H-1,4-benzoxathiepin-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate Traditional Name: 3,5-dihydro-2H-1,4-benzoxathiepin-5-carboxylic acid ethyl ester Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=CC=CC=C2OCCS1

Isomeric SMILES

CCOC(=O)C1C2=CC=CC=C2OCCS1

InChI

InChI=1S/C12H14O3S/c1-2-14-12(13)11-9-5-3-4-6-10(9)15-7-8-16-11/h3-6,11H,2,7-8H2,1H3