(phenylmethyl) 4-oxidanylazepane-1-carboxylate

Systemtic Name: (phenylmethyl) 4-oxidanylazepane-1-carboxylate Openeye Name: benzyl 4-hydroxyazepane-1-carboxylate CAS Name: 4-hydroxy-1-azepanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-hydroxyazepane-1-carboxylate Traditional Name: 4-hydroxyazepane-1-carboxylic acid benzyl ester Formula: C14H19NO3 MolecularWeight: 249.30556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

C1CC(CCN(C1)C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C14H19NO3/c16-13-7-4-9-15(10-8-13)14(17)18-11-12-5-2-1-3-6-12/h1-3,5-6,13,16H,4,7-11H2