methyl 2-[4-(bromomethyl)-2-(1-methylcyclohexyl)phenoxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[4-(bromomethyl)-2-(1-methylcyclohexyl)phenoxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-(bromomethyl)-2-(1-methylcyclohexyl)phenoxy]-2-phenyl-acetate CAS Name: 2-[4-(bromomethyl)-2-(1-methylcyclohexyl)phenoxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-(bromomethyl)-2-(1-methylcyclohexyl)phenoxy]-2-phenylacetate Traditional Name: 2-[4-(bromomethyl)-2-(1-methylcyclohexyl)phenoxy]-2-phenyl-acetic acid methyl ester Formula: C23H27BrO3 MolecularWeight: 431.36268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C2=C(C=CC(=C2)CBr)OC(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1(CCCCC1)C2=C(C=CC(=C2)CBr)OC(C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H27BrO3/c1-23(13-7-4-8-14-23)19-15-17(16-24)11-12-20(19)27-21(22(25)26-2)18-9-5-3-6-10-18/h3,5-6,9-12,15,21H,4,7-8,13-14,16H2,1-2H3