ethyl 4-[12-(4-fluorophenyl)dodec-11-ynylamino]benzoate

Systemtic Name: ethyl 4-[12-(4-fluorophenyl)dodec-11-ynylamino]benzoate Openeye Name: ethyl 4-[12-(4-fluorophenyl)dodec-11-ynylamino]benzoate CAS Name: 4-[12-(4-fluorophenyl)dodec-11-ynylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[12-(4-fluorophenyl)dodec-11-ynylamino]benzoate Traditional Name: 4-[12-(4-fluorophenyl)dodec-11-ynylamino]benzoic acid ethyl ester Formula: C27H34FNO2 MolecularWeight: 423.562763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34FNO2/c1-2-31-27(30)24-16-20-26(21-17-24)29-22-12-10-8-6-4-3-5-7-9-11-13-23-14-18-25(28)19-15-23/h14-21,29H,2-10,12,22H2,1H3