2-[3-bromanyl-5-(2-hydroxyethyl)benzo[b][1]benzothiepin-6-yl]ethanol

Systemtic Name: 2-[3-bromanyl-5-(2-hydroxyethyl)benzo[b][1]benzothiepin-6-yl]ethanol Openeye Name: 2-[3-bromo-5-(2-hydroxyethyl)benzo[b][1]benzothiepin-6-yl]ethanol CAS Name: 2-[3-bromo-5-(2-hydroxyethyl)-6-benzo[b][1]benzothiepinyl]ethanol IUPAC Name: 2-[3-bromo-5-(2-hydroxyethyl)benzo[b][1]benzothiepin-6-yl]ethanol Traditional Name: 2-[3-bromo-5-(2-hydroxyethyl)benzo[b][1]benzothiepin-6-yl]ethanol Formula: C18H17BrO2S MolecularWeight: 377.29538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C3=C(S2)C=CC(=C3)Br)CCO)CCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C3=C(S2)C=CC(=C3)Br)CCO)CCO

InChI

InChI=1S/C18H17BrO2S/c19-12-5-6-18-16(11-12)14(8-10-21)13(7-9-20)15-3-1-2-4-17(15)22-18/h1-6,11,20-21H,7-10H2