(4-butoxycarbonylphenyl) 4-(5-propylpyridin-2-yl)benzoate

Systemtic Name: (4-butoxycarbonylphenyl) 4-(5-propylpyridin-2-yl)benzoate Openeye Name: (4-butoxycarbonylphenyl) 4-(5-propyl-2-pyridyl)benzoate CAS Name: 4-(5-propyl-2-pyridinyl)benzoic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) 4-(5-propylpyridin-2-yl)benzoate Traditional Name: 4-(5-propyl-2-pyridyl)benzoic acid (4-butoxycarbonylphenyl) ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC=C(C=C3)CCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC=C(C=C3)CCC

InChI

InChI=1S/C26H27NO4/c1-3-5-17-30-25(28)21-12-14-23(15-13-21)31-26(29)22-10-8-20(9-11-22)24-16-7-19(6-4-2)18-27-24/h7-16,18H,3-6,17H2,1-2H3