1-(3-chloranylbenzo[b][1]benzothiepin-5-yl)oxypropan-2-one

Systemtic Name: 1-(3-chloranylbenzo[b][1]benzothiepin-5-yl)oxypropan-2-one Openeye Name: 1-(3-chlorobenzo[b][1]benzothiepin-5-yl)oxypropan-2-one CAS Name: 1-[(3-chloro-5-benzo[b][1]benzothiepinyl)oxy]-2-propanone IUPAC Name: 1-(3-chlorobenzo[b][1]benzothiepin-5-yl)oxypropan-2-one Traditional Name: 1-(3-chlorobenzo[b][1]benzothiepin-5-yl)oxyacetone Formula: C17H13ClO2S MolecularWeight: 316.80192

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

Isomeric SMILES

CC(=O)COC1=CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C17H13ClO2S/c1-11(19)10-20-15-8-12-4-2-3-5-16(12)21-17-7-6-13(18)9-14(15)17/h2-9H,10H2,1H3