6-azanyl-5,6-dihydrobenzo[b][1]benzothiepine-2,3-diol hydrobromide

Systemtic Name: 6-azanyl-5,6-dihydrobenzo[b][1]benzothiepine-2,3-diol hydrobromide Openeye Name: 6-amino-5,6-dihydrobenzo[b][1]benzothiepine-2,3-diol hydrobromide CAS Name: 6-amino-5,6-dihydrobenzo[b][1]benzothiepin-2,3-diol hydrobromide IUPAC Name: 6-amino-5,6-dihydrobenzo[b][1]benzothiepine-2,3-diol hydrobromide Traditional Name: 6-amino-5,6-dihydrobenzo[b][1]benzothiepin-2,3-diol hydrobromide Formula: C14H14BrNO2S MolecularWeight: 340.23546

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2SC3=CC(=C(C=C31)O)O)N.Br

Isomeric SMILES

C1C(C2=CC=CC=C2SC3=CC(=C(C=C31)O)O)N.Br

InChI

InChI=1S/C14H13NO2S.BrH/c15-10-5-8-6-11(16)12(17)7-14(8)18-13-4-2-1-3-9(10)13;/h1-4,6-7,10,16-17H,5,15H2;1H