[4-[2-(5-pentoxypyridin-2-yl)ethyl]phenyl] 4-butoxybenzoate

Systemtic Name: [4-[2-(5-pentoxypyridin-2-yl)ethyl]phenyl] 4-butoxybenzoate Openeye Name: [4-[2-(5-pentoxy-2-pyridyl)ethyl]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [4-[2-(5-pentoxy-2-pyridinyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(5-pentoxypyridin-2-yl)ethyl]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [4-[2-(5-amoxy-2-pyridyl)ethyl]phenyl] ester Formula: C29H35NO4 MolecularWeight: 461.5925

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CN=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCOC1=CN=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C29H35NO4/c1-3-5-7-21-33-28-19-14-25(30-22-28)13-8-23-9-15-27(16-10-23)34-29(31)24-11-17-26(18-12-24)32-20-6-4-2/h9-12,14-19,22H,3-8,13,20-21H2,1-2H3