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

Systemtic Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoranylmethoxy)phenyl]cyclohexane-1-carboxylate Openeye Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]cyclohexanecarboxylate CAS Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]-1-cyclohexanecarboxylate IUPAC Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]cyclohexane-1-carboxylate Traditional Name: 4-cyano-4-[3-(cyclopropylmethoxy)-4-(fluoromethoxy)phenyl]cyclohexanecarboxylate Formula: C19H21FNO4- MolecularWeight: 346.372743

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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)/p-1