[2-[[3-butyl-2-oxidanylidene-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[3-butyl-2-oxidanylidene-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[3-butyl-2-oxo-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[3-butyl-2-oxo-5-propyl-4-(trifluoromethyl)-1-imidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[3-butyl-2-oxo-5-propyl-4-(trifluoromethyl)imidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[3-butyl-2-keto-5-propyl-4-(trifluoromethyl)-4-imidazolin-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C25H27F3N2O4 MolecularWeight: 476.48809

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N(C1=O)CC2=CC=CC(=C2OC(=O)O)C3=CC=CC=C3)CCC)C(F)(F)F

Isomeric SMILES

CCCCN1C(=C(N(C1=O)CC2=CC=CC(=C2OC(=O)O)C3=CC=CC=C3)CCC)C(F)(F)F

InChI

InChI=1S/C25H27F3N2O4/c1-3-5-15-29-22(25(26,27)28)20(10-4-2)30(23(29)31)16-18-13-9-14-19(21(18)34-24(32)33)17-11-7-6-8-12-17/h6-9,11-14H,3-5,10,15-16H2,1-2H3,(H,32,33)