ethyl (3R,4S)-4-oxidanylazepane-3-carboxylate

Systemtic Name: ethyl (3R,4S)-4-oxidanylazepane-3-carboxylate Openeye Name: ethyl (3R,4S)-4-hydroxyazepane-3-carboxylate CAS Name: (3R,4S)-4-hydroxy-3-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4S)-4-hydroxyazepane-3-carboxylate Traditional Name: (3R,4S)-4-hydroxyazepane-3-carboxylic acid ethyl ester Formula: C9H17NO3 MolecularWeight: 187.23618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CNCCCC1O

Isomeric SMILES

CCOC(=O)[C@@H]1CNCCC[C@@H]1O

InChI

InChI=1S/C9H17NO3/c1-2-13-9(12)7-6-10-5-3-4-8(7)11/h7-8,10-11H,2-6H2,1H3/t7-,8+/m1/s1