2-(3H-1,2-benzothiazepin-2-yl)ethanoic acid

Systemtic Name: 2-(3H-1,2-benzothiazepin-2-yl)ethanoic acid Openeye Name: 2-(3H-1,2-benzothiazepin-2-yl)acetic acid CAS Name: 2-(3H-1,2-benzothiazepin-2-yl)acetic acid IUPAC Name: 2-(3H-1,2-benzothiazepin-2-yl)acetic acid Traditional Name: 2-(3H-1,2-benzothiazepin-2-yl)acetic acid Formula: C11H11NO2S MolecularWeight: 221.27554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2=CC=CC=C2SN1CC(=O)O

Isomeric SMILES

C1C=CC2=CC=CC=C2SN1CC(=O)O

InChI

InChI=1S/C11H11NO2S/c13-11(14)8-12-7-3-5-9-4-1-2-6-10(9)15-12/h1-6H,7-8H2,(H,13,14)