(2-oxidanylideneazepan-3-yl) 2-(2-methoxy-4-methyl-phenoxy)ethanoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 2-(2-methoxy-4-methyl-phenoxy)ethanoate Openeye Name: (2-oxoazepan-3-yl) 2-(2-methoxy-4-methyl-phenoxy)acetate CAS Name: 2-(2-methoxy-4-methylphenoxy)acetic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 2-(2-methoxy-4-methylphenoxy)acetate Traditional Name: 2-(2-methoxy-4-methyl-phenoxy)acetic acid (2-ketoazepan-3-yl) ester Formula: C16H21NO5 MolecularWeight: 307.34164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)OC2CCCCNC2=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)OC2CCCCNC2=O)OC

InChI

InChI=1S/C16H21NO5/c1-11-6-7-12(14(9-11)20-2)21-10-15(18)22-13-5-3-4-8-17-16(13)19/h6-7,9,13H,3-5,8,10H2,1-2H3,(H,17,19)