ethyl 2-(4-propanoyl-2,6-dipropyl-phenoxy)-2-pyridin-3-yl-ethanoate

Systemtic Name: ethyl 2-(4-propanoyl-2,6-dipropyl-phenoxy)-2-pyridin-3-yl-ethanoate Openeye Name: ethyl 2-(4-propanoyl-2,6-dipropyl-phenoxy)-2-(3-pyridyl)acetate CAS Name: 2-[4-(1-oxopropyl)-2,6-dipropylphenoxy]-2-(3-pyridinyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-propanoyl-2,6-dipropylphenoxy)-2-pyridin-3-ylacetate Traditional Name: 2-(4-propionyl-2,6-dipropyl-phenoxy)-2-(3-pyridyl)acetic acid ethyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1OC(C2=CN=CC=C2)C(=O)OCC)CCC)C(=O)CC

Isomeric SMILES

CCCC1=CC(=CC(=C1OC(C2=CN=CC=C2)C(=O)OCC)CCC)C(=O)CC

InChI

InChI=1S/C24H31NO4/c1-5-10-17-14-20(21(26)7-3)15-18(11-6-2)22(17)29-23(24(27)28-8-4)19-12-9-13-25-16-19/h9,12-16,23H,5-8,10-11H2,1-4H3