2-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-8-yl)ethanoic acid

Systemtic Name: 2-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-8-yl)ethanoic acid Openeye Name: 2-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-8-yl)acetic acid CAS Name: 2-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-8-yl)acetic acid IUPAC Name: 2-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-8-yl)acetic acid Traditional Name: 2-(2,10a-dihydro-1H-benzo[c][1,5]benzoxathiepin-8-yl)acetic acid Formula: C15H14O3S MolecularWeight: 274.33486

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1)OC=C3C=C(C=CC3S2)CC(=O)O

Isomeric SMILES

C1CC2=C(C=C1)OC=C3C=C(C=CC3S2)CC(=O)O

InChI

InChI=1S/C15H14O3S/c16-15(17)8-10-5-6-13-11(7-10)9-18-12-3-1-2-4-14(12)19-13/h1,3,5-7,9,13H,2,4,8H2,(H,16,17)