ethyl 4-[8-(furan-2-yl)oct-7-ynylamino]benzoate

Systemtic Name: ethyl 4-[8-(furan-2-yl)oct-7-ynylamino]benzoate Openeye Name: ethyl 4-[8-(2-furyl)oct-7-ynylamino]benzoate CAS Name: 4-[8-(2-furanyl)oct-7-ynylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[8-(furan-2-yl)oct-7-ynylamino]benzoate Traditional Name: 4-[8-(2-furyl)oct-7-ynylamino]benzoic acid ethyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCCCCCC#CC2=CC=CO2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCCCCCC#CC2=CC=CO2

InChI

InChI=1S/C21H25NO3/c1-2-24-21(23)18-12-14-19(15-13-18)22-16-8-6-4-3-5-7-10-20-11-9-17-25-20/h9,11-15,17,22H,2-6,8,16H2,1H3