2-(1,2-benzothiazepin-5-yl)ethanoate

Systemtic Name: 2-(1,2-benzothiazepin-5-yl)ethanoate Openeye Name: 2-(1,2-benzothiazepin-5-yl)acetate CAS Name: 2-(1,2-benzothiazepin-5-yl)acetate IUPAC Name: 2-(1,2-benzothiazepin-5-yl)acetate Traditional Name: 2-(1,2-benzothiazepin-5-yl)acetate Formula: C11H8NO2S- MolecularWeight: 218.25172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=NS2)CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=NS2)CC(=O)[O-]

InChI

InChI=1S/C11H9NO2S/c13-11(14)7-8-5-6-12-15-10-4-2-1-3-9(8)10/h1-6H,7H2,(H,13,14)/p-1