tert-butyl 2-(2H-1,5-benzothiazepin-5-yl)ethanoate

Systemtic Name: tert-butyl 2-(2H-1,5-benzothiazepin-5-yl)ethanoate Openeye Name: tert-butyl 2-(2H-1,5-benzothiazepin-5-yl)acetate CAS Name: 2-(2H-1,5-benzothiazepin-5-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2H-1,5-benzothiazepin-5-yl)acetate Traditional Name: 2-(2H-1,5-benzothiazepin-5-yl)acetic acid tert-butyl ester Formula: C15H19NO2S MolecularWeight: 277.38186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=CCSC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=CCSC2=CC=CC=C21

InChI

InChI=1S/C15H19NO2S/c1-15(2,3)18-14(17)11-16-9-6-10-19-13-8-5-4-7-12(13)16/h4-9H,10-11H2,1-3H3