[4-[2-(5-pentylpyridin-2-yl)ethyl]phenyl] 4-pentoxybenzoate

Systemtic Name: [4-[2-(5-pentylpyridin-2-yl)ethyl]phenyl] 4-pentoxybenzoate Openeye Name: [4-[2-(5-pentyl-2-pyridyl)ethyl]phenyl] 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [4-[2-(5-pentyl-2-pyridinyl)ethyl]phenyl] ester IUPAC Name: [4-[2-(5-pentylpyridin-2-yl)ethyl]phenyl] 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [4-[2-(5-amyl-2-pyridyl)ethyl]phenyl] ester Formula: C30H37NO3 MolecularWeight: 459.61968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCC

Isomeric SMILES

CCCCCC1=CN=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCC

InChI

InChI=1S/C30H37NO3/c1-3-5-7-9-25-11-17-27(31-23-25)16-10-24-12-18-29(19-13-24)34-30(32)26-14-20-28(21-15-26)33-22-8-6-4-2/h11-15,17-21,23H,3-10,16,22H2,1-2H3