(E)-18-quinolin-8-yloctadec-9-enoate

Systemtic Name: (E)-18-quinolin-8-yloctadec-9-enoate Openeye Name: (E)-18-(8-quinolyl)octadec-9-enoate CAS Name: (E)-18-(8-quinolinyl)-9-octadecenoate IUPAC Name: (E)-18-quinolin-8-yloctadec-9-enoate Traditional Name: (E)-18-(8-quinolyl)octadec-9-enoate Formula: C27H38NO2- MolecularWeight: 408.59612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCCCCCCCC=CCCCCCCCC(=O)[O-])N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CCCCCCCC/C=C/CCCCCCCC(=O)[O-])N=CC=C2

InChI

InChI=1S/C27H39NO2/c29-26(30)22-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-18-24-19-16-20-25-21-17-23-28-27(24)25/h1,3,16-17,19-21,23H,2,4-15,18,22H2,(H,29,30)/p-1/b3-1+