methyl 7-[4-(3-bromanylpropoxy)phenoxy]-2,2-dimethyl-heptanoate

Systemtic Name: methyl 7-[4-(3-bromanylpropoxy)phenoxy]-2,2-dimethyl-heptanoate Openeye Name: methyl 7-[4-(3-bromopropoxy)phenoxy]-2,2-dimethyl-heptanoate CAS Name: 7-[4-(3-bromopropoxy)phenoxy]-2,2-dimethylheptanoic acid methyl ester IUPAC Name: methyl 7-[4-(3-bromopropoxy)phenoxy]-2,2-dimethylheptanoate Traditional Name: 7-[4-(3-bromopropoxy)phenoxy]-2,2-dimethyl-enanthic acid methyl ester Formula: C19H29BrO4 MolecularWeight: 401.33516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCOC1=CC=C(C=C1)OCCCBr)C(=O)OC

Isomeric SMILES

CC(C)(CCCCCOC1=CC=C(C=C1)OCCCBr)C(=O)OC

InChI

InChI=1S/C19H29BrO4/c1-19(2,18(21)22-3)12-5-4-6-14-23-16-8-10-17(11-9-16)24-15-7-13-20/h8-11H,4-7,12-15H2,1-3H3