(5Z)-3-(4-hexadecylphenyl)-5-(oxidanylmethylidene)-2-(trifluoromethyl)imidazol-4-one

Systemtic Name: (5Z)-3-(4-hexadecylphenyl)-5-(oxidanylmethylidene)-2-(trifluoromethyl)imidazol-4-one Openeye Name: (5Z)-3-(4-hexadecylphenyl)-5-(hydroxymethylene)-2-(trifluoromethyl)imidazol-4-one CAS Name: (5Z)-3-(4-hexadecylphenyl)-5-(hydroxymethylidene)-2-(trifluoromethyl)-4-imidazolone IUPAC Name: (5Z)-3-(4-hexadecylphenyl)-5-(hydroxymethylidene)-2-(trifluoromethyl)imidazol-4-one Traditional Name: (5Z)-3-(4-cetylphenyl)-5-(hydroxymethylene)-2-(trifluoromethyl)-2-imidazolin-4-one Formula: C27H39F3N2O2 MolecularWeight: 480.60597

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)N2C(=O)C(=CO)N=C2C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)N2C(=O)/C(=C/O)/N=C2C(F)(F)F

InChI

InChI=1S/C27H39F3N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-17-19-23(20-18-22)32-25(34)24(21-33)31-26(32)27(28,29)30/h17-21,33H,2-16H2,1H3/b24-21-