quinolin-8-yl (E)-octadec-9-enoate

Systemtic Name: quinolin-8-yl (E)-octadec-9-enoate Openeye Name: 8-quinolyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 8-quinolyl ester Formula: C27H39NO2 MolecularWeight: 409.60406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC1=CC=CC2=C1N=CC=C2

InChI

InChI=1S/C27H39NO2/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/h9-10,17-21,23H,2-8,11-16,22H2,1H3/b10-9+