octan-2-yl 4-[2-fluoranyl-4-(4-propylcyclohexyl)phenyl]benzoate

Systemtic Name: octan-2-yl 4-[2-fluoranyl-4-(4-propylcyclohexyl)phenyl]benzoate Openeye Name: 1-methylheptyl 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoate CAS Name: 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoate Traditional Name: 4-[2-fluoro-4-(4-propylcyclohexyl)phenyl]benzoic acid 1-methylheptyl ester Formula: C30H41FO2 MolecularWeight: 452.643743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C3CCC(CC3)CCC)F

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)C3CCC(CC3)CCC)F

InChI

InChI=1S/C30H41FO2/c1-4-6-7-8-10-22(3)33-30(32)26-17-15-25(16-18-26)28-20-19-27(21-29(28)31)24-13-11-23(9-5-2)12-14-24/h15-24H,4-14H2,1-3H3