propyl 7-methoxy-3,4-dihydro-2H-1,5-benzoxathiepine-4-carboxylate

Systemtic Name: propyl 7-methoxy-3,4-dihydro-2H-1,5-benzoxathiepine-4-carboxylate Openeye Name: propyl 7-methoxy-3,4-dihydro-2H-1,5-benzoxathiepine-4-carboxylate CAS Name: 7-methoxy-3,4-dihydro-2H-1,5-benzoxathiepin-4-carboxylic acid propyl ester IUPAC Name: propyl 7-methoxy-3,4-dihydro-2H-1,5-benzoxathiepine-4-carboxylate Traditional Name: 7-methoxy-3,4-dihydro-2H-1,5-benzoxathiepin-4-carboxylic acid propyl ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1CCOC2=C(S1)C=C(C=C2)OC

Isomeric SMILES

CCCOC(=O)C1CCOC2=C(S1)C=C(C=C2)OC

InChI

InChI=1S/C14H18O4S/c1-3-7-18-14(15)12-6-8-17-11-5-4-10(16-2)9-13(11)19-12/h4-5,9,12H,3,6-8H2,1-2H3