2-(4-propanoyl-2,6-dipropyl-phenoxy)-2-pyridin-3-yl-ethanoic acid

Systemtic Name: 2-(4-propanoyl-2,6-dipropyl-phenoxy)-2-pyridin-3-yl-ethanoic acid Openeye Name: 2-(4-propanoyl-2,6-dipropyl-phenoxy)-2-(3-pyridyl)acetic acid CAS Name: 2-[4-(1-oxopropyl)-2,6-dipropylphenoxy]-2-(3-pyridinyl)acetic acid IUPAC Name: 2-(4-propanoyl-2,6-dipropylphenoxy)-2-pyridin-3-ylacetic acid Traditional Name: 2-(4-propionyl-2,6-dipropyl-phenoxy)-2-(3-pyridyl)acetic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO4/c1-4-8-15-12-18(19(24)6-3)13-16(9-5-2)20(15)27-21(22(25)26)17-10-7-11-23-14-17/h7,10-14,21H,4-6,8-9H2,1-3H3,(H,25,26)