(2-bromanyl-4-phenyl-phenyl) 4-(3-methyl-4-propan-2-yl-phenoxy)butanoate

Systemtic Name: (2-bromanyl-4-phenyl-phenyl) 4-(3-methyl-4-propan-2-yl-phenoxy)butanoate Openeye Name: (2-bromo-4-phenyl-phenyl) 4-(4-isopropyl-3-methyl-phenoxy)butanoate CAS Name: 4-(3-methyl-4-propan-2-ylphenoxy)butanoic acid (2-bromo-4-phenylphenyl) ester IUPAC Name: (2-bromo-4-phenylphenyl) 4-(3-methyl-4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(4-isopropyl-3-methyl-phenoxy)butyric acid (2-bromo-4-phenyl-phenyl) ester Formula: C26H27BrO3 MolecularWeight: 467.39478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)OC2=C(C=C(C=C2)C3=CC=CC=C3)Br)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)OC2=C(C=C(C=C2)C3=CC=CC=C3)Br)C(C)C

InChI

InChI=1S/C26H27BrO3/c1-18(2)23-13-12-22(16-19(23)3)29-15-7-10-26(28)30-25-14-11-21(17-24(25)27)20-8-5-4-6-9-20/h4-6,8-9,11-14,16-18H,7,10,15H2,1-3H3