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

Systemtic Name: [2-[[3-butyl-4-(fluoranylmethyl)-2-oxidanylidene-5-propyl-imidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[3-butyl-4-(fluoromethyl)-2-oxo-5-propyl-imidazol-1-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[3-butyl-4-(fluoromethyl)-2-oxo-5-propyl-1-imidazolyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[3-butyl-4-(fluoromethyl)-2-oxo-5-propylimidazol-1-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[3-butyl-4-(fluoromethyl)-2-keto-5-propyl-4-imidazolin-1-yl]methyl]-6-phenyl-phenyl] ester Formula: C25H29FN2O4 MolecularWeight: 440.507163

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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)CF

Isomeric SMILES

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

InChI

InChI=1S/C25H29FN2O4/c1-3-5-15-27-22(16-26)21(10-4-2)28(24(27)29)17-19-13-9-14-20(23(19)32-25(30)31)18-11-7-6-8-12-18/h6-9,11-14H,3-5,10,15-17H2,1-2H3,(H,30,31)