3-bromanyl-5,6-dimethyl-6H-benzo[b][1]benzothiepin-5-ol

Systemtic Name: 3-bromanyl-5,6-dimethyl-6H-benzo[b][1]benzothiepin-5-ol Openeye Name: 3-bromo-5,6-dimethyl-6H-benzo[b][1]benzothiepin-5-ol CAS Name: 3-bromo-5,6-dimethyl-6H-benzo[b][1]benzothiepin-5-ol IUPAC Name: 3-bromo-5,6-dimethyl-6H-benzo[b][1]benzothiepin-5-ol Traditional Name: 3-bromo-5,6-dimethyl-6H-benzo[b][1]benzothiepin-5-ol Formula: C16H15BrOS MolecularWeight: 335.2587

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2SC3=C(C1(C)O)C=C(C=C3)Br

Isomeric SMILES

CC1C2=CC=CC=C2SC3=C(C1(C)O)C=C(C=C3)Br

InChI

InChI=1S/C16H15BrOS/c1-10-12-5-3-4-6-14(12)19-15-8-7-11(17)9-13(15)16(10,2)18/h3-10,18H,1-2H3