phenacyl 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-3-methyl-butanoate

Systemtic Name: phenacyl 2-[[2,6-bis(fluoranyl)phenyl]carbonylamino]-3-methyl-butanoate Openeye Name: phenacyl 2-[(2,6-difluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2,6-difluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid phenacyl ester IUPAC Name: phenacyl 2-[(2,6-difluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2,6-difluorobenzoyl)amino]-3-methyl-butyric acid phenacyl ester Formula: C20H19F2NO4 MolecularWeight: 375.365966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19F2NO4/c1-12(2)18(23-19(25)17-14(21)9-6-10-15(17)22)20(26)27-11-16(24)13-7-4-3-5-8-13/h3-10,12,18H,11H2,1-2H3,(H,23,25)