2-(1-oxidanyl-2-phenoxy-ethyl)azepane-1-carboxylic acid

Systemtic Name: 2-(1-oxidanyl-2-phenoxy-ethyl)azepane-1-carboxylic acid Openeye Name: 2-(1-hydroxy-2-phenoxy-ethyl)azepane-1-carboxylic acid CAS Name: 2-(1-hydroxy-2-phenoxyethyl)-1-azepanecarboxylic acid IUPAC Name: 2-(1-hydroxy-2-phenoxyethyl)azepane-1-carboxylic acid Traditional Name: 2-(1-hydroxy-2-phenoxy-ethyl)azepane-1-carboxylic acid Formula: C15H21NO4 MolecularWeight: 279.33154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(CC1)C(=O)O)C(COC2=CC=CC=C2)O

Isomeric SMILES

C1CCC(N(CC1)C(=O)O)C(COC2=CC=CC=C2)O

InChI

InChI=1S/C15H21NO4/c17-14(11-20-12-7-3-1-4-8-12)13-9-5-2-6-10-16(13)15(18)19/h1,3-4,7-8,13-14,17H,2,5-6,9-11H2,(H,18,19)