ethyl 2-(4-ethanoyl-3-methoxy-phenoxy)ethanoate; 3-pyridin-4-yl-1,4-diazabicyclo[2.2.0]hexane

Systemtic Name: ethyl 2-(4-ethanoyl-3-methoxy-phenoxy)ethanoate; 3-pyridin-4-yl-1,4-diazabicyclo[2.2.0]hexane Openeye Name: ethyl 2-(4-acetyl-3-methoxy-phenoxy)acetate; 3-(4-pyridyl)-1,4-diazabicyclo[2.2.0]hexane CAS Name: 2-(4-acetyl-3-methoxyphenoxy)acetic acid ethyl ester; 3-pyridin-4-yl-1,4-diazabicyclo[2.2.0]hexane IUPAC Name: ethyl 2-(4-acetyl-3-methoxyphenoxy)acetate; 3-pyridin-4-yl-1,4-diazabicyclo[2.2.0]hexane Traditional Name: 2-(4-acetyl-3-methoxy-phenoxy)acetic acid ethyl ester; 3-(4-pyridyl)-1,4-diazabicyclo[2.2.0]hexane Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC(=C(C=C1)C(=O)C)OC.C1CN2N1CC2C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)COC1=CC(=C(C=C1)C(=O)C)OC.C1CN2N1CC2C3=CC=NC=C3

InChI

InChI=1S/C13H16O5.C9H11N3/c1-4-17-13(15)8-18-10-5-6-11(9(2)14)12(7-10)16-3;1-3-10-4-2-8(1)9-7-11-5-6-12(9)11/h5-7H,4,8H2,1-3H3;1-4,9H,5-7H2