4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoranylmethoxy)phenyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoranylmethoxy)phenyl]cyclohexane-1-carboxylic acid Openeye Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]cyclohexanecarboxylic acid CAS Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]cyclohexane-1-carboxylic acid Traditional Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]cyclohexanecarboxylic acid Formula: C19H22FNO4 MolecularWeight: 347.380683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC2=C(C=CC(=C2)C3(CCC(CC3)C(=O)O)C#N)OCF

Isomeric SMILES

C1CC1COC2=C(C=CC(=C2)C3(CCC(CC3)C(=O)O)C#N)OCF

InChI

InChI=1S/C19H22FNO4/c20-12-25-16-4-3-15(9-17(16)24-10-13-1-2-13)19(11-21)7-5-14(6-8-19)18(22)23/h3-4,9,13-14H,1-2,5-8,10,12H2,(H,22,23)