ethyl 4-(4-pyridin-2-ylbut-3-ynylamino)benzoate

Systemtic Name: ethyl 4-(4-pyridin-2-ylbut-3-ynylamino)benzoate Openeye Name: ethyl 4-[4-(2-pyridyl)but-3-ynylamino]benzoate CAS Name: 4-[4-(2-pyridinyl)but-3-ynylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-pyridin-2-ylbut-3-ynylamino)benzoate Traditional Name: 4-[4-(2-pyridyl)but-3-ynylamino]benzoic acid ethyl ester Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCC#CC2=CC=CC=N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCC#CC2=CC=CC=N2

InChI

InChI=1S/C18H18N2O2/c1-2-22-18(21)15-9-11-17(12-10-15)20-14-6-4-8-16-7-3-5-13-19-16/h3,5,7,9-13,20H,2,6,14H2,1H3