[cyano-[3-(4-fluoranylphenoxy)phenyl]methyl] 2-propan-2-ylpent-4-ynoate

Systemtic Name: [cyano-[3-(4-fluoranylphenoxy)phenyl]methyl] 2-propan-2-ylpent-4-ynoate Openeye Name: [cyano-[3-(4-fluorophenoxy)phenyl]methyl] 2-isopropylpent-4-ynoate CAS Name: 2-propan-2-yl-4-pentynoic acid [cyano-[3-(4-fluorophenoxy)phenyl]methyl] ester IUPAC Name: [cyano-[3-(4-fluorophenoxy)phenyl]methyl] 2-propan-2-ylpent-4-ynoate Traditional Name: 2-isopropylpent-4-ynoic acid [cyano-[3-(4-fluorophenoxy)phenyl]methyl] ester Formula: C22H20FNO3 MolecularWeight: 365.397503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC#C)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)C(CC#C)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=C(C=C2)F

InChI

InChI=1S/C22H20FNO3/c1-4-6-20(15(2)3)22(25)27-21(14-24)16-7-5-8-19(13-16)26-18-11-9-17(23)10-12-18/h1,5,7-13,15,20-21H,6H2,2-3H3