ethyl 6-methoxy-3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate

Systemtic Name: ethyl 6-methoxy-3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate Openeye Name: ethyl 6-methoxy-3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate CAS Name: 6-methoxy-3,5-dihydro-2H-1,4-benzoxathiepin-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methoxy-3,5-dihydro-2H-1,4-benzoxathiepine-5-carboxylate Traditional Name: 6-methoxy-3,5-dihydro-2H-1,4-benzoxathiepin-5-carboxylic acid ethyl ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=C(C=CC=C2OC)OCCS1

Isomeric SMILES

CCOC(=O)C1C2=C(C=CC=C2OC)OCCS1

InChI

InChI=1S/C13H16O4S/c1-3-16-13(14)12-11-9(15-2)5-4-6-10(11)17-7-8-18-12/h4-6,12H,3,7-8H2,1-2H3