quinolin-8-yl octadecanoate

Systemtic Name: quinolin-8-yl octadecanoate Openeye Name: 8-quinolyl octadecanoate CAS Name: octadecanoic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl octadecanoate Traditional Name: stearic acid 8-quinolyl ester Formula: C27H41NO2 MolecularWeight: 411.61994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC2=C1N=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C27H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-26(29)30-25-21-17-19-24-20-18-23-28-27(24)25/h17-21,23H,2-16,22H2,1H3