1-[6,8-bis(chloranyl)-7-iodanyl-benzo[e][1]benzothiol-4-yl]-2-piperidin-1-yl-ethanol

Systemtic Name: 1-[6,8-bis(chloranyl)-7-iodanyl-benzo[e][1]benzothiol-4-yl]-2-piperidin-1-yl-ethanol Openeye Name: 1-(6,8-dichloro-7-iodo-benzo[e]benzothiophen-4-yl)-2-(1-piperidyl)ethanol CAS Name: 1-(6,8-dichloro-7-iodo-4-benzo[e][1]benzothiolyl)-2-(1-piperidinyl)ethanol IUPAC Name: 1-(6,8-dichloro-7-iodobenzo[e][1]benzothiol-4-yl)-2-piperidin-1-ylethanol Traditional Name: 1-(6,8-dichloro-7-iodo-benzo[e]benzothiophen-4-yl)-2-piperidino-ethanol Formula: C19H18Cl2INOS MolecularWeight: 506.22779

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(C2=C3C(=C4C=C(C(=C(C4=C2)Cl)I)Cl)C=CS3)O

Isomeric SMILES

C1CCN(CC1)CC(C2=C3C(=C4C=C(C(=C(C4=C2)Cl)I)Cl)C=CS3)O

InChI

InChI=1S/C19H18Cl2INOS/c20-15-9-12-11-4-7-25-19(11)14(8-13(12)17(21)18(15)22)16(24)10-23-5-2-1-3-6-23/h4,7-9,16,24H,1-3,5-6,10H2