(1-butoxy-1-oxidanylidene-propan-2-yl) 4-(5-propylpyridin-2-yl)benzoate

Systemtic Name: (1-butoxy-1-oxidanylidene-propan-2-yl) 4-(5-propylpyridin-2-yl)benzoate Openeye Name: (2-butoxy-1-methyl-2-oxo-ethyl) 4-(5-propyl-2-pyridyl)benzoate CAS Name: 4-(5-propyl-2-pyridinyl)benzoic acid (1-butoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-butoxy-1-oxopropan-2-yl) 4-(5-propylpyridin-2-yl)benzoate Traditional Name: 4-(5-propyl-2-pyridyl)benzoic acid (2-butoxy-2-keto-1-methyl-ethyl) ester Formula: C22H27NO4 MolecularWeight: 369.45408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)OC(=O)C1=CC=C(C=C1)C2=NC=C(C=C2)CCC

Isomeric SMILES

CCCCOC(=O)C(C)OC(=O)C1=CC=C(C=C1)C2=NC=C(C=C2)CCC

InChI

InChI=1S/C22H27NO4/c1-4-6-14-26-21(24)16(3)27-22(25)19-11-9-18(10-12-19)20-13-8-17(7-5-2)15-23-20/h8-13,15-16H,4-7,14H2,1-3H3