methyl 3-[2-(diethylaminodiazenyl)-5-(trifluoromethyl)phenyl]prop-2-ynoate

Systemtic Name: methyl 3-[2-(diethylaminodiazenyl)-5-(trifluoromethyl)phenyl]prop-2-ynoate Openeye Name: methyl 3-[2-(diethylaminoazo)-5-(trifluoromethyl)phenyl]prop-2-ynoate CAS Name: 3-[2-(diethylaminoazo)-5-(trifluoromethyl)phenyl]-2-propynoic acid methyl ester IUPAC Name: methyl 3-[2-(diethylaminodiazenyl)-5-(trifluoromethyl)phenyl]prop-2-ynoate Traditional Name: 3-[2-(diethylaminoazo)-5-(trifluoromethyl)phenyl]propiolic acid methyl ester Formula: C15H16F3N3O2 MolecularWeight: 327.30165

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)N=NC1=C(C=C(C=C1)C(F)(F)F)C#CC(=O)OC

Isomeric SMILES

CCN(CC)N=NC1=C(C=C(C=C1)C(F)(F)F)C#CC(=O)OC

InChI

InChI=1S/C15H16F3N3O2/c1-4-21(5-2)20-19-13-8-7-12(15(16,17)18)10-11(13)6-9-14(22)23-3/h7-8,10H,4-5H2,1-3H3