(6-oxidanylidene-1,2-dihydrobenzo[b][4,1]benzoxathiepin-8-yl)methyl ethanoate

Systemtic Name: (6-oxidanylidene-1,2-dihydrobenzo[b][4,1]benzoxathiepin-8-yl)methyl ethanoate Openeye Name: (6-oxo-1,2-dihydrobenzo[b][4,1]benzoxathiepin-8-yl)methyl acetate CAS Name: acetic acid (6-oxo-1,2-dihydrobenzo[b][4,1]benzoxathiepin-8-yl)methyl ester IUPAC Name: (6-oxo-1,2-dihydrobenzo[b][4,1]benzoxathiepin-8-yl)methyl acetate Traditional Name: acetic acid (6-keto-1,2-dihydrobenzo[b][4,1]benzoxathiepin-8-yl)methyl ester Formula: C16H14O4S MolecularWeight: 302.34496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC2=C(C=C1)SC3=C(C=CCC3)OC2=O

Isomeric SMILES

CC(=O)OCC1=CC2=C(C=C1)SC3=C(C=CCC3)OC2=O

InChI

InChI=1S/C16H14O4S/c1-10(17)19-9-11-6-7-14-12(8-11)16(18)20-13-4-2-3-5-15(13)21-14/h2,4,6-8H,3,5,9H2,1H3