[1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 2-benzamido-3-methyl-pentanoate

Systemtic Name: [1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 2-benzamido-3-methyl-pentanoate Openeye Name: [1-(difluoromethyl)imidazol-2-yl]methyl 2-benzamido-3-methyl-pentanoate CAS Name: 2-benzamido-3-methylpentanoic acid [1-(difluoromethyl)-2-imidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)imidazol-2-yl]methyl 2-benzamido-3-methylpentanoate Traditional Name: 2-benzamido-3-methyl-valeric acid [1-(difluoromethyl)imidazol-2-yl]methyl ester Formula: C18H21F2N3O3 MolecularWeight: 365.374446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC1=NC=CN1C(F)F)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OCC1=NC=CN1C(F)F)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21F2N3O3/c1-3-12(2)15(22-16(24)13-7-5-4-6-8-13)17(25)26-11-14-21-9-10-23(14)18(19)20/h4-10,12,15,18H,3,11H2,1-2H3,(H,22,24)