1-[4-(5-nonylpyridin-2-yl)phenoxy]propan-2-yl heptanoate

Systemtic Name: 1-[4-(5-nonylpyridin-2-yl)phenoxy]propan-2-yl heptanoate Openeye Name: [1-methyl-2-[4-(5-nonyl-2-pyridyl)phenoxy]ethyl] heptanoate CAS Name: heptanoic acid 1-[4-(5-nonyl-2-pyridinyl)phenoxy]propan-2-yl ester IUPAC Name: 1-[4-(5-nonylpyridin-2-yl)phenoxy]propan-2-yl heptanoate Traditional Name: enanthic acid [1-methyl-2-[4-(5-nonyl-2-pyridyl)phenoxy]ethyl] ester Formula: C30H45NO3 MolecularWeight: 467.6832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OCC(C)OC(=O)CCCCCC

InChI

InChI=1S/C30H45NO3/c1-4-6-8-10-11-12-13-15-26-17-22-29(31-23-26)27-18-20-28(21-19-27)33-24-25(3)34-30(32)16-14-9-7-5-2/h17-23,25H,4-16,24H2,1-3H3