2-(5-azanyl-4-oxidanylidene-1,3-thiazepan-3-yl)ethanoic acid

Systemtic Name: 2-(5-azanyl-4-oxidanylidene-1,3-thiazepan-3-yl)ethanoic acid Openeye Name: 2-(5-amino-4-oxo-1,3-thiazepan-3-yl)acetic acid CAS Name: 2-(5-amino-4-oxo-1,3-thiazepan-3-yl)acetic acid IUPAC Name: 2-(5-amino-4-oxo-1,3-thiazepan-3-yl)acetic acid Traditional Name: 2-(5-amino-4-keto-1,3-thiazepan-3-yl)acetic acid Formula: C7H12N2O3S MolecularWeight: 204.24678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCN(C(=O)C1N)CC(=O)O

Isomeric SMILES

C1CSCN(C(=O)C1N)CC(=O)O

InChI

InChI=1S/C7H12N2O3S/c8-5-1-2-13-4-9(7(5)12)3-6(10)11/h5H,1-4,8H2,(H,10,11)