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

Systemtic Name: (4-heptoxycarbonylphenyl) 4-(5-propylpyridin-2-yl)benzoate Openeye Name: (4-heptoxycarbonylphenyl) 4-(5-propyl-2-pyridyl)benzoate CAS Name: 4-(5-propyl-2-pyridinyl)benzoic acid [4-[heptoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-heptoxycarbonylphenyl) 4-(5-propylpyridin-2-yl)benzoate Traditional Name: 4-(5-propyl-2-pyridyl)benzoic acid (4-heptoxycarbonylphenyl) ester Formula: C29H33NO4 MolecularWeight: 459.57662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33NO4/c1-3-5-6-7-8-20-33-28(31)24-15-17-26(18-16-24)34-29(32)25-13-11-23(12-14-25)27-19-10-22(9-4-2)21-30-27/h10-19,21H,3-9,20H2,1-2H3