2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)propanoic acid

Systemtic Name: 2-(5-oxidanylidenepyrido[2,3-b][1,5]benzothiazepin-6-yl)propanoic acid Openeye Name: 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)propanoic acid CAS Name: 2-(5-oxo-6-pyrido[2,3-b][1,5]benzothiazepinyl)propanoic acid IUPAC Name: 2-(5-oxopyrido[2,3-b][1,5]benzothiazepin-6-yl)propanoic acid Traditional Name: 2-(5-ketopyrido[2,3-b][1,5]benzothiazepin-6-yl)propionic acid Formula: C15H12N2O3S MolecularWeight: 300.33238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C2=CC=CC=C2SC3=C(C1=O)C=CC=N3

Isomeric SMILES

CC(C(=O)O)N1C2=CC=CC=C2SC3=C(C1=O)C=CC=N3

InChI

InChI=1S/C15H12N2O3S/c1-9(15(19)20)17-11-6-2-3-7-12(11)21-13-10(14(17)18)5-4-8-16-13/h2-9H,1H3,(H,19,20)