2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol hydrochloride

Systemtic Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol hydrochloride Openeye Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol hydrochloride CAS Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol hydrochloride IUPAC Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol hydrochloride Traditional Name: 2-(methylamino)-4,5-dihydro-1,3-benzothiazepine-7,8-diol hydrochloride Formula: C10H13ClN2O2S MolecularWeight: 260.74042

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NCCC2=CC(=C(C=C2S1)O)O.Cl

Isomeric SMILES

CNC1=NCCC2=CC(=C(C=C2S1)O)O.Cl

InChI

InChI=1S/C10H12N2O2S.ClH/c1-11-10-12-3-2-6-4-7(13)8(14)5-9(6)15-10;/h4-5,13-14H,2-3H2,1H3,(H,11,12);1H