3-cyclohexyl-6-methyl-1-phenoxycarbonyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridazine-5-carboxylic acid

Systemtic Name: 3-cyclohexyl-6-methyl-1-phenoxycarbonyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridazine-5-carboxylic acid Openeye Name: 3-cyclohexyl-6-methyl-1-phenoxycarbonyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridazine-5-carboxylic acid CAS Name: 3-cyclohexyl-6-methyl-1-[oxo(phenoxy)methyl]-4-[4-(trifluoromethyl)phenyl]-4H-pyridazine-5-carboxylic acid IUPAC Name: 3-cyclohexyl-6-methyl-1-phenoxycarbonyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridazine-5-carboxylic acid Traditional Name: 1-carbophenoxy-3-cyclohexyl-6-methyl-4-[4-(trifluoromethyl)phenyl]-4H-pyridazine-5-carboxylic acid Formula: C26H25F3N2O4 MolecularWeight: 486.48291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=NN1C(=O)OC2=CC=CC=C2)C3CCCCC3)C4=CC=C(C=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C(C(=NN1C(=O)OC2=CC=CC=C2)C3CCCCC3)C4=CC=C(C=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C26H25F3N2O4/c1-16-21(24(32)33)22(17-12-14-19(15-13-17)26(27,28)29)23(18-8-4-2-5-9-18)30-31(16)25(34)35-20-10-6-3-7-11-20/h3,6-7,10-15,18,22H,2,4-5,8-9H2,1H3,(H,32,33)