methyl (7R)-7-(5-ethanoyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)heptanoate

Systemtic Name: methyl (7R)-7-(5-ethanoyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)heptanoate Openeye Name: methyl (7R)-7-(5-acetyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)heptanoate CAS Name: (7R)-7-(5-acetyl-2-methoxy-3,4,6-trimethylphenyl)-7-(4-fluorophenyl)heptanoic acid methyl ester IUPAC Name: methyl (7R)-7-(5-acetyl-2-methoxy-3,4,6-trimethylphenyl)-7-(4-fluorophenyl)heptanoate Traditional Name: (7R)-7-(5-acetyl-2-methoxy-3,4,6-trimethyl-phenyl)-7-(4-fluorophenyl)enanthic acid methyl ester Formula: C26H33FO4 MolecularWeight: 428.536223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)OC)C(CCCCCC(=O)OC)C2=CC=C(C=C2)F)C)C(=O)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)OC)[C@H](CCCCCC(=O)OC)C2=CC=C(C=C2)F)C)C(=O)C

InChI

InChI=1S/C26H33FO4/c1-16-17(2)26(31-6)25(18(3)24(16)19(4)28)22(20-12-14-21(27)15-13-20)10-8-7-9-11-23(29)30-5/h12-15,22H,7-11H2,1-6H3/t22-/m1/s1