2-(7-oxidanylideneazepan-3-yl)sulfinylethanoic acid

Systemtic Name: 2-(7-oxidanylideneazepan-3-yl)sulfinylethanoic acid Openeye Name: 2-(7-oxoazepan-3-yl)sulfinylacetic acid CAS Name: 2-[(7-oxo-3-azepanyl)sulfinyl]acetic acid IUPAC Name: 2-(7-oxoazepan-3-yl)sulfinylacetic acid Traditional Name: 2-(7-ketoazepan-3-yl)sulfinylacetic acid Formula: C8H13NO4S MolecularWeight: 219.25812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC(=O)C1)S(=O)CC(=O)O

Isomeric SMILES

C1CC(CNC(=O)C1)S(=O)CC(=O)O

InChI

InChI=1S/C8H13NO4S/c10-7-3-1-2-6(4-9-7)14(13)5-8(11)12/h6H,1-5H2,(H,9,10)(H,11,12)