(2,6-dimethoxyphenyl) 2,3-bis(1,4-oxazepan-4-yl)propanoate

Systemtic Name: (2,6-dimethoxyphenyl) 2,3-bis(1,4-oxazepan-4-yl)propanoate Openeye Name: (2,6-dimethoxyphenyl) 2,3-bis(1,4-oxazepan-4-yl)propanoate CAS Name: 2,3-bis(1,4-oxazepan-4-yl)propanoic acid (2,6-dimethoxyphenyl) ester IUPAC Name: (2,6-dimethoxyphenyl) 2,3-bis(1,4-oxazepan-4-yl)propanoate Traditional Name: 2,3-bis(1,4-oxazepan-4-yl)propionic acid (2,6-dimethoxyphenyl) ester Formula: C21H32N2O6 MolecularWeight: 408.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OC(=O)C(CN2CCCOCC2)N3CCCOCC3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OC(=O)C(CN2CCCOCC2)N3CCCOCC3

InChI

InChI=1S/C21H32N2O6/c1-25-18-6-3-7-19(26-2)20(18)29-21(24)17(23-9-5-13-28-15-11-23)16-22-8-4-12-27-14-10-22/h3,6-7,17H,4-5,8-16H2,1-2H3