11-bromanyl-11-[4-(4-methylphenyl)carbonylphenyl]undecanoic acid

Systemtic Name: 11-bromanyl-11-[4-(4-methylphenyl)carbonylphenyl]undecanoic acid Openeye Name: 11-bromo-11-[4-(4-methylbenzoyl)phenyl]undecanoic acid CAS Name: 11-bromo-11-[4-[(4-methylphenyl)-oxomethyl]phenyl]undecanoic acid IUPAC Name: 11-bromo-11-[4-(4-methylbenzoyl)phenyl]undecanoic acid Traditional Name: 11-bromo-11-(4-p-toluoylphenyl)undecanoic acid Formula: C25H31BrO3 MolecularWeight: 459.41584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(CCCCCCCCCC(=O)O)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(CCCCCCCCCC(=O)O)Br

InChI

InChI=1S/C25H31BrO3/c1-19-11-13-21(14-12-19)25(29)22-17-15-20(16-18-22)23(26)9-7-5-3-2-4-6-8-10-24(27)28/h11-18,23H,2-10H2,1H3,(H,27,28)