ethyl 3-[4-[12-(4-fluorophenyl)dodec-11-ynylamino]phenyl]propanoate

Systemtic Name: ethyl 3-[4-[12-(4-fluorophenyl)dodec-11-ynylamino]phenyl]propanoate Openeye Name: ethyl 3-[4-[12-(4-fluorophenyl)dodec-11-ynylamino]phenyl]propanoate CAS Name: 3-[4-[12-(4-fluorophenyl)dodec-11-ynylamino]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[12-(4-fluorophenyl)dodec-11-ynylamino]phenyl]propanoate Traditional Name: 3-[4-[12-(4-fluorophenyl)dodec-11-ynylamino]phenyl]propionic acid ethyl ester Formula: C29H38FNO2 MolecularWeight: 451.615923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=C(C=C1)NCCCCCCCCCCC#CC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)CCC1=CC=C(C=C1)NCCCCCCCCCCC#CC2=CC=C(C=C2)F

InChI

InChI=1S/C29H38FNO2/c1-2-33-29(32)23-18-26-16-21-28(22-17-26)31-24-12-10-8-6-4-3-5-7-9-11-13-25-14-19-27(30)20-15-25/h14-17,19-22,31H,2-10,12,18,23-24H2,1H3