3-(4-fluoranylphenoxy)propyl 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: 3-(4-fluoranylphenoxy)propyl 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: 3-(4-fluorophenoxy)propyl 2-[(2-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid 3-(4-fluorophenoxy)propyl ester IUPAC Name: 3-(4-fluorophenoxy)propyl 2-[(2-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-fluorobenzoyl)amino]-3-methyl-butyric acid 3-(4-fluorophenoxy)propyl ester Formula: C21H23F2NO4 MolecularWeight: 391.408426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCCCOC1=CC=C(C=C1)F)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)C(C(=O)OCCCOC1=CC=C(C=C1)F)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C21H23F2NO4/c1-14(2)19(24-20(25)17-6-3-4-7-18(17)23)21(26)28-13-5-12-27-16-10-8-15(22)9-11-16/h3-4,6-11,14,19H,5,12-13H2,1-2H3,(H,24,25)